# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-29T01:35:18+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (volume = 31 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1000039","15.263","0.003","15.263","0.003","15.263","0.003","90","","90","","90","","3555.7","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Calcium cyclo-hexaaluminate","","- Al6 Ca9 O18 -","- Al6 Ca9 O18 -","- Al48 Ca72 O144 -","8","0.333333","","Mondal, P; Jeffery, J W","The crystal structure of tricalcium aluminate, Ca~3~ Al~2~ O~6~","Acta Crystallographica B (24,1968-38,1982)","1975","31","","689","697","10.1107/S0567740875003639","","","","","","0.051","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000057","4.157","0.0001","4.157","0.0001","4.157","0.0001","90","","90","","90","","71.8","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","Lanthanum boride (1/6)","","- B6 La -","- B6 La -","- B6 La -","1","0.0208333","","Eliseev, A A; Efremmov, V A; Kuz'micheva, G M; Konovalova, E S; Lazorenko, V I; Paderno, Y B; Khlyustova, S Y","X-ray structural investigation of single crystals of lanthanum, cerium, and samarium hexaborides","Kristallografiya","1986","31","","803","805","","","","","","","","","","","","","","","","","","","","","","has coordinates","303120","2025-10-31","16:25:07",""
"1000370","10.945","0.002","10.945","0.002","14.756","0.004","90","","90","","120","","1530.8","","","","","","","","","","","","","3","P 63 c m","P 6c -2","185","","Tricaesium nonafluorodigallate","","- Cs3 F9 Ga2 -","- Cs3 F9 Ga2 -","- Cs18 F54 Ga12 -","6","0.5","","de Kozak, A; Mary, Y; Gredin, P; Renaudin, J; Ferey, G; Babel, D","The crystal structure of the binuclear fluorocompound Cs3 Ga2 F9","European Journal of Solid State Inorganic Chemistry","1994","31","","115","122","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000371","10.658","0.001","20.62799","0.002","17.55099","0.002","90","","113.038","0.007","90","","3550.9","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Triammonia tris(tetraamminepalladium) heptamolybdate(VI)","","- H45 Mo7 N15 O24 Pd3 -","- H45 Mo7 N15 O24 Pd3 -","- H180 Mo28 N60 O96 Pd12 -","4","1","","Laligant, Y","Crystal structure of the heptamolybdate(VI) (paramolybdate) (N H3)3 (Pd (N H3)4)3 Mo7 O24","European Journal of Solid State Inorganic Chemistry","1994","31","","211","222","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","301771","2025-08-18","12:22:44",""
"1000372","3.972","0.001","5.038","0.002","9.005","0.005","90","","90","","90","","180.2","","","","","","","","","","","","","5","P m c 21","P 2c -2","26","","Potassium copper carbonate fluoride","","- C Cu F K O3 -","- C Cu F K O3 -","- C2 Cu2 F2 K2 O6 -","2","0.5","","Mercier, N; Leblanc, M","Synthesis, characterization and crystal structure of a new copper fluorocarbonate K Cu (C O3) F","European Journal of Solid State Inorganic Chemistry","1994","31","","423","430","","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000373","6.399","0.001","3.59","0.001","7.22","0.002","90","","110.29","0.01","90","","155.6","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","Sodium vanadium dioxide difluoride","","- F2 Na O2 V -","- F2 Na O2 V -","- F4 Na2 O4 V2 -","2","1","","Crosnier-Lopez, M - P; Duroy, H; Fourquet, J - L; Abrabri, M","Synthesis and crystal structure of Na V O2 F2","European Journal of Solid State Inorganic Chemistry","1994","31","","957","965","","","","","","","0.027","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000377","9.689","0.001","9.703","0.001","9.788","0.001","90","","102.78","0.02","90","","897.4","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Ammonium aquahydroxobis(phosphato)digallate hydrate","","- Ga2 H9 N O11 P2 -","- Ga2 H13 N O11 P2 -","- Ga8 H52 N4 O44 P8 -","4","1","","Loiseau, T; Ferey, G","Crystal structure of (N H4) (Ga2 (P O4)2(O H)(H2 O)),(H2 O), isotypic with ALPO4-15","European Journal of Solid State Inorganic Chemistry","1994","31","","575","581","","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001022","7.8","0.003","13.011","0.004","5.546","0.002","90","","90","","98.6","0.02","556.5","","","","","","","","","","","","","3","P 1 1 21","P 2c","4","","DILANTHANUM DITITANIUM OXIDE","","- La2 O7 Ti2 -","- La2 O7 Ti2 -","- La8 O28 Ti8 -","4","2","","Gasperin, M","Dititanate de lanthane","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2129","2130","10.1107/S0567740875007005","","","","","","0.075","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001081","6.447","","3.797","","18.431","","90","","90","","90","","451.2","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Potassium titanium niobium oxide","","- K Nb O5 Ti -","- K Nb O5 Ti -","- K4 Nb4 O20 Ti4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1- x~(Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001082","6.474","","3.8","","18.765","","90","","90","","90","","461.6","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Potassium titanium niobium oxide (0.9/0.9/1.2/5)","","- K0.85 Nb1.15 O5 Ti0.85 -","- K0.85 Nb1.15 O5 Ti0.85 -","- K3.4 Nb4.6 O20 Ti3.4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001083","6.472","","3.814","","18.943","","90","","90","","90","","467.6","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Rubidium titanium niobium oxide","","- Nb O5 Rb Ti -","- Nb O5 Rb Ti -","- Nb4 O20 Rb4 Ti4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.073","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001084","6.499","","3.812","","19.36","","90","","90","","90","","479.6","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Rubidium titanium niobium oxide (0.9/0.9/1.2/5)","","- Nb1.15 O5 Rb0.85 Ti0.85 -","- Nb1.15 O5 Rb0.85 Ti0.85 -","- Nb4.6 O20 Rb3.4 Ti3.4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001085","6.456","","3.806","","18.844","","90","","90","","90","","463","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Thallium titanium niobium oxide","","- Nb O5 Ti Tl -","- Nb O5 Ti Tl -","- Nb4 O20 Ti4 Tl4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The comnounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.063","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001086","6.457","","3.799","","18.919","","90","","90","","90","","464.1","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Thallium titanium niobium oxide (.9/.9/1.1/5)","","- Nb1.1 O5 Ti0.9 Tl0.9 -","- Nb1.1 O5 Ti0.9 Tl0.9 -","- Nb4.4 O20 Ti3.6 Tl3.6 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The comoounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001087","6.437","","3.797","","18.474","","90","","90","","90","","451.5","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Potassium titanium tantalum oxide","","- K O5 Ta Ti -","- K O5 Ta Ti -","- K4 O20 Ta4 Ti4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.068","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001088","6.451","","3.812","","19","","90","","90","","90","","467.2","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Rubidium titanium tantalum oxide","","- O5 Rb Ta Ti -","- O5 Rb Ta Ti -","- O20 Rb4 Ta4 Ti4 -","4","0.5","","Rebbah, A; Desgardin, G; Raveau, B","Nonstoichiometric oxides with a layer structure: The compounds A~1-x~ (Ti~1-x~ M~1+x~) O~5~","Journal of Solid State Chemistry","1980","31","","321","328","10.1016/0022-4596(80)90094-8","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001624","12.993","0.001","12.993","0.001","12.993","0.001","90","","90","","90","","2193.5","","","","","","","","","","","","","3","P a -3","-P 2ac 2ab 3","205","","Cadmium iodide arsenide (4/3/2)","","- As2 Cd4 I3 -","- As2 Cd4 I3 -","- As16 Cd32 I24 -","8","0.333333","","Gallay, J; Allais, G; Deschanvres, A","Structure de Cd4 As2 I3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2274","2276","10.1107/S0567740875007388","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001629","3.8048","","3.8048","","30.46799","","90","","90","","90","","441.1","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Thallium strontium iron oxide (0.97/4/2/9)","","- Fe2 O9 Sr4 Tl0.965 -","- Fe2 O9 Sr4 Tl0.9648 -","- Fe4 O18 Sr8 Tl1.9296 -","2","0.0625","","Daniel, P; Barbey, L; Groult, D; Nguyen, N; Van Tendeloo, G; Raveau, B","Mixed valent iron oxides with the 0201-1201 intergrowth structure: (Pb1- x Tlx) Sr4 Fe2 O9 (0<x<1)","European Journal of Solid State Inorganic Chemistry","1994","31","","235","244","","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001630","16.67799","0.003","16.67799","0.003","12.717","0.003","90","","90","","120","","3063.4","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Caesium molybdenum phosphorus oxide hydrate (8.35/13/10/62/1)","","- Cs8.35 H2 Mo13 O63 P10 -","- Cs8.351 H2.3333 Mo13 O63 P10 -","- Cs16.702 H4.6666 Mo26 O126 P20 -","2","0.166667","","Hoareau, T; Leclaire, A; Borel, M - M; Grandin, A; Raveau, B","A zeolitic mixed valence molybdenum monophosphate with a tunnel structure: Cs8+x (Mo O4) Mo12 O18 (P O4)10 .(H2 O)","European Journal of Solid State Inorganic Chemistry","1994","31","","727","737","","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001754","7.735","0.001","12.655","0.001","8.324","0.001","90","","105.97","0.01","90","","783.4","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Lithium molybdenum tungsten oxide phosphate (0.5/1/1/3/2)","","- Li0.5 Mo O11 P2 W -","- Li0.5 Mo0.9995 O11 P2 W1.0005 -","- Li2 Mo3.998 O44 P8 W4.002 -","4","1","","Leclaire, A; Borel, M M; Chardon, J; Raveau, B","Nonstoichiometry in the Li Mo2 (P O4)3 structure: the molybdenotungsten monophosphate Li0.5 Mo W O3 (P O4)2","Materials Research Bulletin","1996","31","10","1257","1262","10.1016/0025-5408(96)00116-X","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001755","3.8801","0.0002","3.8801","0.0002","9.495","0.001","90","","90","","90","","142.9","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Mercury cerium barium copper oxide (0.85/0.15/2/1/4.15)","","- Ba2 Ce0.15 Cu Hg0.85 O4.15 -","- Ba2 Ce0.15 Cu Hg0.85 O4.15 -","- Ba2 Ce0.15 Cu Hg0.85 O4.15 -","1","0.0625","","Letouze, F; Huve, M; Martin, C; Maignan, A; Michel, C; Hervieu, M; Raveau, B","Introduction of lanthanide on the mercury site of the Hg Ba2 Cu O4 superconductor","Materials Research Bulletin","1996","31","6","657","663","10.1016/0025-5408(96)00049-9","","","","","","0.078","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001756","4.3499","0.0002","4.3499","0.0002","25.36699","0.001","90","","90","","90","","480","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Dithallium tribarium dichloride pentaoxide","","- Ba3 Cl2 O5 Tl2 -","- Ba3 Cl2 O5 Tl2 -","- Ba6 Cl4 O10 Tl4 -","2","0.0625","","Letouze, F; Martin, C; Pelloquin, D; Michel, C; Hervieu, M; Raveau, B","A thallium oxychloride closely related to the Sr3 Ti2 O7 and Y Ba Fe Cu O5 structures: Ba3 Tl2 O5 Cl2","Materials Research Bulletin","1996","31","7","773","780","10.1016/0025-5408(96)00065-7","","","","","","0.059","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004024","6.3245","0.0001","7.5422","0.0001","11.0095","0.0002","90","","90.12","0.02","90","","525.2","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Diammonium oxotetrafluorotitanate","","- F4 H8 N2 O Ti -","- F4 H13 N2 O Ti -","- F16 H52 N8 O4 Ti4 -","4","1","","Patarin, J; Marcuccilli-Hoffner, F; Kessler, H; Daniels, P","Synthesis and structure determination of (N H4)2 Ti F4 O","European Journal of Solid State Inorganic Chemistry","1994","31","","501","511","","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004105","11.776","0.001","5.173","0.0006","7.7903","0.0006","90","","90","","90","","474.6","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Bismuth dicopper phosphate(V) dioxide","","- Bi Cu2 O6 P -","- Bi Cu2 O6 P -","- Bi4 Cu8 O24 P4 -","4","0.5","","Abraham, F; Ketatni, M; Mairesse, G; Mernari, B","Crystal structure of a new bismuth copper oxyphosphate: Bi Cu2 P O6","European Journal of Solid State Inorganic Chemistry","1994","31","","313","323","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004106","5.312","0.001","8.789","0.002","16.06699","0.003","90","","90.72","0.01","90","","750.1","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dibarium nickel bis(phosphate(V))","","- Ba2 Ni O8 P2 -","- Ba2 Ni O8 P2 -","- Ba8 Ni4 O32 P8 -","4","1","","Elbali, B; Boukhari, A; Aride, J; Belaiche, M; Abraham, F; Drillon, M","Crystal structure and magnetic properties of Ba2 Ni (P O4)2","European Journal of Solid State Inorganic Chemistry","1994","31","","61","73","","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005003","7.84","0.001","14.431","0.002","6.237","0.001","90","","90","","90","","705.6","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Niobium(II) cobalt telluride","","- Co Nb Te2 -","- Co Nb Te2 -","- Co8 Nb8 Te16 -","8","","","Li, J; Badding, M E; DiSalvo, F J","New layered ternary niobium tellurides: synthesis, structure and properties of NbMTe~2~ (M=Fe, Co)","Inorganic Chemistry","1992","31","","1050","1054","10.1021/ic00032a024","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005004","7.922","0.001","7.239","0.001","6.243","0.001","90","","90","","90","","358","","","","","","","","","","","","","3","P m n a","-P 2ac 2","53","","Niobium(II) iron telluride","","- Fe Nb Te2 -","- Fe Nb Te2 -","- Fe4 Nb4 Te8 -","4","0.5","","Li, J; Badding, M E; DiSalvo, F J","New layered ternary niobium tellurides: synthesis, structure and properties of NbMTe~2~ (M=Fe, Co)","Inorganic Chemistry","1992","31","","1050","1054","10.1021/ic00032a024","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005012","10.033","0.003","10.033","0.003","10.033","0.003","90","","90","","90","","1009.9","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Barium cobalt sulfide (6/25/27)","","- Ba6 Co25 S27 -","- Ba6 Co25 S27 -","- Ba6 Co25 S27 -","1","0.0208333","","Snyder, G J; Badding, M E; DiSalvo, F J","Synthesis, structure and properties of Ba~6~Co~25~S~27~: a perovskite- like superstructure of Co~8~S~6~ and Ba~6~S clusters","Inorganic Chemistry","1992","31","","2107","2110","10.1021/ic00037a024","","","","","","0.026","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007025","9.109","0.002","13.543","0.002","8.814","0.002","102.21","0.01","113.35","0.01","95.92","0.01","954.3","","","","","","","","","","","","","5","P -1","-P 1","2","","Zinc potassium hydrogenbis(phosphate) hydrate (2/1/1/2.5)","","- H6 K O10.5 P2 Zn2 -","- H4.5 K O10.5 P2 Zn2 -","- H18 K4 O42 P8 Zn8 -","4","2","","Tordjman, I; Durif, A; Averbuch-Pouchot, M T; Guitel, J C","Structure cristalline du monophosphate de zinc-potassium: Zn~2~ K H (P O~4~)~2~ (H~2~ O)~2.5~","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1143","1148","10.1107/S0567740875004682","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007026","7.8","0.005","7.796","0.005","9.276","0.005","115.15","0.05","115.15","0.05","88.93","0.05","453.1","","","","","","","","","","","","","4","P -1","-P 1","2","","SILVER CYCLO-TRIPHOSPHATE HYDRATE","","- Ag3 H2 O10 P3 -","- Ag3 H O10 P3 -","- Ag6 H2 O20 P6 -","2","1","","Bagieu-Beucher, M; Durif, A; Guitel, J C","Structure cristalline du trimetaphosphate d'argent monohydrate, Ag~3~ P~3~ O~9~ H~2~ O","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2264","2267","10.1107/S0567740875007364","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1007027","26.52","0.03","7.625","0.005","12.92","0.01","90","","100.93","0.05","90","","2565.2","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","DIBARIUM ZINC CYCLO-TRIPHOSPHATE DECAHYDRATE","","- Ba2 H20 O28 P6 Zn -","- Ba2 H20 O28 P6 Zn -","- Ba8 H80 O112 P24 Zn4 -","4","0.5","","Durif, A; Averbuch-Pouchot, M T; Guitel, J C","Structure cristalline du trimetaphosphate de baryum-zinc decahydrate Ba~2~ Zn (P~3~ O~9~)~2~ (H~2~ O)~10~","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2680","2682","10.1107/S056774087500845X","","","","","","0.059","","","","","","","","","","","","","","","has coordinates","186636","2020-10-21","18:00:00",""
"1007228","14.05","0.03","17.09","0.04","7.228","0.003","90","","103.85","0.05","90","","1685.1","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Lead rubidium catena-tris(phosphate(V))","","- O9 P3 Pb Rb -","- O9 P3 Pb Rb -","- O72 P24 Pb8 Rb8 -","8","2","","Prisset, J - L; Averbuch-Pouchot, M - T; Durif, A","The Pb (P O3)2-Rb (P O3) phase-equilibrium crystal structure of Pb Rb (P O3)3","European Journal of Solid State Inorganic Chemistry","1994","31","","37","46","","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007251","14.94","0.01","9.192","0.007","7.219","0.005","90","","90.79","0.01","90","","991.3","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cadmium barium tetrakis(catena-phosphate(V))","","- Ba Cd O12 P4 -","- Ba Cd O12 P4 -","- Ba4 Cd4 O48 P16 -","4","1","","Averbuch-Pouchot, M T; Durif, A; Guitel, J C","Structure cristalline du polyphophate de cadmium-baryum: Cd Ba (P O3)4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2453","2456","10.1107/S0567740875007789","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007252","10.766","0.008","10.316","0.008","8.525","0.005","111.39","0.05","115.08","0.05","70.19","0.05","779.2","","","","","","","","","","","","","4","P -1","-P 1","2","","Pentazinc bis(triphosphate(V)) 17-hydrate","","- H34 O37 P6 Zn5 -","- H34 O37 P6 Zn5 -","- H34 O37 P6 Zn5 -","1","0.5","","Averbuch-Pouchot, M T; Durif, A; Guitel, J C","Structure cristalline du tripolyphosphate de zinc heptadecahydrate: Zn5 (P3 O10)2 (H2 O)17","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2482","2486","10.1107/S0567740875007832","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008000","9.559","0.009","8.668","0.008","5.015","0.005","90","","90","","90","","415.5","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Molybdenum hexafluoride","","- F6 Mo -","- F6 Mo -","- F24 Mo4 -","4","0.5","","Levy, J. H.; Taylor, J. C.; Wilson, P. W.","Structures of fluorides. IX. The orthorhombic form of molybdenum hexafluoride","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1975","31","","398","401","10.1107/S0567740875002890","","","","","","0.11","","","","","","","","","","","","","","","has coordinates","297366","2025-01-17","10:57:25",""
"1008021","14.011","0.016","4.328","0.005","10.005","0.011","90","","90","","90","","606.7","","","","","","","","","","","","","2","C c m m","-C 2c 2c","63","","URANIUM(III) IODIDE","","- I3 U -","- I3 U -","- I12 U4 -","4","0.25","","Levy, J H; Taylor, J C; Wilson, P W","The structure of uranium(III) triiodide by neutron diffraction","Acta Crystallographica B (24,1968-38,1982)","1975","31","","880","882","10.1107/S0567740875003986","","","","","","0.15","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008022","6.221","0.005","6.221","0.005","6.221","0.005","90","","90","","90","","240.8","","","","","","","","","","","","","2","I 4 3 2","I 4 2 3","211","","Molybdenum hexafluoride","","- F6 Mo -","- F6 Mo -","- F12 Mo2 -","2","0.0416667","","Levy, J. H.; Sanger, P. L.; Taylor, J. C.; Wilson, P. W.","The structures of fluorides. XI. Cubic harmonic analysis of the neutron diffraction pattern of the body-centred cubic phase of Mo F~6~ at 266 K","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1975","31","","1065","1067","10.1107/S0567740875004505","","","","","","0.103","","","","","","","","","","","","","","","has coordinates","301771","2025-08-18","12:22:45",""
"1008053","3.885","","3.885","","12.784","","90","","90","","90","","193","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Lanthanum strontium iron(III) oxide","","- Fe La O4 Sr -","- Fe La O4 Sr -","- Fe2 La2 O8 Sr2 -","2","0.0625","","Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G","La phase Sr La Fe O~4~: Structures cristalline et magnetique","Journal of Solid State Chemistry","1980","31","","313","320","10.1016/0022-4596(80)90093-6","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008054","3.878","","3.878","","12.723","","90","","90","","90","","191.3","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Lanthanum strontium iron(III) oxide","","- Fe La O4 Sr -","- Fe La O4 Sr -","- Fe2 La2 O8 Sr2 -","2","0.0625","","Soubeyroux, J L; Courbin, P; Fournes, L; Fruchart, D; le Flem, G","La phase Sr La Fe O~4~: Structures cristalline et magnetique","Journal of Solid State Chemistry","1980","31","","313","320","10.1016/0022-4596(80)90093-6","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008055","11.844","","11.844","","11.844","","90","","90","","90","","1661.5","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Rubidium trieuropium fluoride","","- Eu3 F10 Rb -","- Eu3 F10 Rb -","- Eu24 F80 Rb8 -","8","0.0416667","","Arbus, A; Fournier, M T; Picaud, B; Boulon, G; Vedrine, A","Structure Cristalline du Compose Rb Eu~3~ F~10~","Journal of Solid State Chemistry","1980","31","","11","21","10.1016/0022-4596(80)90002-X","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008532","9.688","0.002","8.002","0.001","8.339","0.001","90","","90","","90","","646.5","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","Dithallium catena-pentafluoromanganate(III) hydrate","","- F5 H2 Mn O Tl2 -","- F5 H4 Mn O Tl2 -","- F20 H16 Mn4 O4 Tl8 -","4","0.25","","Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L","A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O","Inorganic Chemistry","1992","31","","770","774","10.1021/ic00031a015","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008533","9.526","0.002","7.861","0.001","8.317","0.001","90","","90","","90","","622.8","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","Dithallium catena-pentafluoromanganate(III) hydrate","","- F5 H2 Mn O Tl2 -","- F5 H4 Mn O Tl2 -","- F20 H16 Mn4 O4 Tl8 -","4","0.25","","Nunez, P; Tressaud, A; Darriet, J; Hagenmuller, P; Hahn, G; Frenzen, G; Massa, W; Babel, D; Boireau, A; Soubeyroux, J L","A new linear chain compound: crystal and magnetic structures of Tl~2~MnF~5~.H~2~O","Inorganic Chemistry","1992","31","","770","774","10.1021/ic00031a015","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1010285","8.89","0.01","8.89","0.01","8.89","0.01","90","","90","","90","","702.6","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Caesium hexafluorosilicate","","- Cs2 F6 Si -","- Cs2 F6 Si -","- Cs8 F24 Si4 -","4","0.0208333","","Schuetz, W","Die kristallchemische Verwandtschaft zwischen Germanium und Silicium.","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","292","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010286","8.99","0.01","8.99","0.01","8.99","0.01","90","","90","","90","","726.6","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Caesium hexafluorogermanate","","- Cs2 F6 Ge -","- Cs2 F6 Ge -","- Cs8 F24 Ge4 -","4","0.0208333","","Schuetz, W","Die kristallchemische Verwandtschaft zwischen Germanium und Silicium.","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","292","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010576","7.42","","7.42","","6.97","","90","","90","","90","","383.7","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","Potassium dihydrogenphosphate","","- H2 K O4 P -","- H0.5 K O P -","- H2 K4 O4 P4 -","4","0.25","","Hassel, O.","Über die Kristallstruktur des primären Kaliumphosphats KH~2~PO~4~ und isomorpher Salze","Zeitschrift für Elektrochemie und angewandte physikalische Chemie","1925","31","10","523","529","10.1002/bbpc.19250311006","","","","","","","","","","","","","","","","","","","","","has coordinates","282478","2023-04-06","12:32:03",""
"1010581","5.84","0.006","5.84","0.006","5.84","0.006","90","","90","","90","","199.2","","","","","","","","","","","","","2","F 2 3","F 2 2 3","196","","Copper(I) selenide - $-alpha","","- Cu2 Se -","- Cu2.0004 Se -","- Cu8.0016 Se4 -","4","0.0833333","","Rahlfs, P","Ueber die kubischen Hochtemperaturmodifikationen der Sulfide und Telluride des Silbers und des einwertigen Kupfers","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","157","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010839","3","0.01","3","0.01","3.25","0.01","90","","90","","120","","25.3","","","","","","","","","","","","","2","","","","","Aluminium boride (1/2)","","- Al B2 -","","","1","","","Hofmann, W; Jaeniche, W","Die Struktur von Aluminiumborid Al B~2~","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","214","222","","","","","","","","","","","","","","","","","","","","","","","35911","2020-10-21","18:00:00",""
"1011299","4.712","0.003","4.712","0.003","4.712","0.003","90","","90","","90","","104.6","","","","","","","","","","","","","2","P m -3 n","-P 4n 2 3","223","","Vanadium silicide (3/1)","","- Si V3 -","- Si V3 -","- Si2 V6 -","2","0.0416667","","Wallbaum, H J","Ueber das Vanadiumsilicid, V3 Si","Zeitschrift fuer Metallkunde","1939","31","","362","362","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011316","4.4","","4.4","","4.4","","90","","90","","90","","85.2","","","","","","","","","","","","synthetic","2","F m -3 m","-F 4 2 3","225","","Titanium(III) nitride","Osbornite","- N Ti -","- N Ti -","- N4 Ti4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011317","4.44","","4.44","","4.44","","90","","90","","90","","87.5","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Scandium(III) nitride","","- N Sc -","- N Sc -","- N4 Sc4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011318","4.28","","4.28","","4.28","","90","","90","","90","","78.4","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Vanadium(III) nitride","Uakitite","- N V -","- N V -","- N4 V4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:44",""
"1011319","4.41","","4.41","","4.41","","90","","90","","90","","85.8","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Niobium(III) nitride","","- N Nb -","- N Nb -","- N4 Nb4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011320","4.6","","4.6","","4.6","","90","","90","","90","","97.3","","","","","","","","","","","","synthetic","2","F m -3 m","-F 4 2 3","225","","Titanium carbide","Khamrabaevite","- C Ti -","- C Ti -","- C4 Ti4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1011321","4.3","","4.3","","4.3","","90","","90","","90","","79.5","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Vanadium(IV) carbide","","- C V -","- C V -","- C4 V4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1011322","4.76","","4.76","","4.76","","90","","90","","90","","107.9","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Zirconium carbide","","- C Zr -","- C Zr -","- C4 Zr4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1011323","4.4","","4.4","","4.4","","90","","90","","90","","85.2","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Niobium carbide (1/1)","","- C Nb -","- C Nb -","- C4 Nb4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1011324","4.49","","4.49","","4.49","","90","","90","","90","","90.5","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Tantalum(IV) carbide","","- C Ta -","- C Ta -","- C4 Ta4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"1011337","4.88","0.02","4.88","0.02","4.88","0.02","90","","90","","90","","116.2","","","","","","","","","","","","synthetic","2","I m -3 m","-I 4 2 3","229","","Silver sulfide - $-alpha","Argentite","- Ag2 S -","- Ag2.0004 S -","- Ag4.0008 S2 -","2","0.0208333","","Rahlfs, P","Ueber die kubischen Hochtemperaturmodifikationen der Sulfide und Telluride des Silbers und des einwertigen Kupfers","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","157","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011338","4.983","0.016","4.983","0.016","4.983","0.016","90","","90","","90","","123.7","","","","","","","","","","","","","2","I m -3 m","-I 4 2 3","229","","Silver selenide - $-alpha","","- Ag2 Se -","- Ag2.0004 Se -","- Ag4.0008 Se2 -","2","0.0208333","","Rahlfs, P","Ueber die kubischen Hochtemperaturmodifikationen der Sulfide und Telluride des Silbers und des einwertigen Kupfers","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","157","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011339","6.572","0.01","6.572","0.01","6.572","0.01","90","","90","","90","","283.9","","","","","","","","","","","","","2","F -4 3 m","F -4 2 3","216","","Silver telluride - $-alpha","","- Ag2 Te -","- Ag2 Te -","- Ag8 Te4 -","4","0.0416667","","Rahlfs, P","Ueber die kubischen Hochtemperaturmodifikationen der Sulfide und Telluride des Silbers und des einwertigen Kupfers","Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie","1936","31","","157","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011361","4.63","","4.63","","4.63","","90","","90","","90","","99.3","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Zirconium(III) nitride","","- N Zr -","- N Zr -","- N4 Zr4 -","4","0.0208333","","Becker, K; Ebert, F","Die Kristallstrukturen einiger binaerer Carbide und Nitride.","Zeitschrift fuer Physik","1925","31","","268","272","10.1007/BF02980580","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100069","6.819","0.002","6.747","0.002","6.506","0.002","94.23","0.02","96.76","0.02","101.72","0.02","289.6","","","","","","","","","","","","","4","P -1","-P 1","2","","Magnesium dithionate hexahydrate","","- H12 Mg O12 S2 -","- H12 Mg O12 S2 -","- H12 Mg O12 S2 -","1","0.5","","Black, W H; Griffith, E A H; Robertson, B E","M S~2~ O~6~ (H~2~ O)~6~ (M = Mg, Ni, Zn)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","615","617","10.1107/S0567740875003408","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100084","7.299","0.006","8.273","0.008","4.94","0.003","90","","99.9","0.06","90","","293.9","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Magnesium bis(hydrogensulfate)","","- H2 Mg O8 S2 -","- H2 Mg O8 S2 -","- H4 Mg2 O16 S4 -","2","0.5","","Simonov, M A; Troyanov, S I; Kemnitz, E; Haas, D; Kammler, M","Crystal structure of Mg (H S O~4~)~2~","Kristallografiya","1986","31","","1220","1221","","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100347","9.097","0.001","9.616","0.001","10.958","0.001","95.31","0.01","93.44","0.01","108.19","0.01","902.75","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H12 O5 W -","- C20 H12 O5 W -","- C40 H24 O10 W2 -","2","1","","Dötz, Karl Heinz; Schäfer, Thomas; Kroll, Friedrich; Harms, Klaus","Alkyne(carbene) Complexes: Stabilization of an Intermediate of Carbene Annelation","Angewandte Chemie, International Edition in English","1992","31","9","1236","1238","10.1002/anie.199212361","","","","","","","","","","","","","","","","","","","","","has coordinates","177006","2020-10-21","18:00:00",""
"1100348","22.077","0.001","12.23","0.001","16.528","0.001","90","","90","","90","","4462.59","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C40 H84 Li4 N8 -","- C42 H95 Li4 N8 -","- C168 H380 Li16 N32 -","4","1","","Boche, Gernot; Langlotz, Ira; Marsch, Michael; Harms, Klaus; Nudelman, Norma E. S.","[Lithium Piperidide-Piperidine]~4~: Crystal Structure of an Oligomeric 1:1 Lithium Amide-Amine Mixed Complex, an Intermediate in the N-Lithiation of Amines","Angewandte Chemie, International Edition in English","1992","31","9","1205","1207","10.1002/anie.199212051","","","","","","","","","","","","","","","","","","","","","has coordinates","176972","2020-10-21","18:00:00",""
"1100353","11.137","0.002","11.26","0.002","18.646","0.004","90","","90","","90","","2338.26","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H38 N2 O5 -","- C20 H38 N2 O5 -","- C80 H152 N8 O20 -","4","1","","Reetz, Manfred T.; Kanand, Jürgen; Griebenow, Nils; Harms, Klaus","Stereoselective Nucleophilic Addition Reactions of Reactive Pseudopeptides","Angewandte Chemie, International Edition in English","1992","31","12","1626","1629","10.1002/anie.199216261","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100355","10.58","0.001","12.645","0.001","18.342","0.002","80.52","0.01","81.69","0.01","73.59","0.01","2309.27","","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C32 H24 O2 -","- C32 H24 O2 -","- C128 H96 O8 -","4","2","","Dötz, Karl Heinz; Schäfer, Thomas; Kroll, Friedrich; Harms, Klaus","Alkyne(carbene) Complexes: Stabilization of an Intermediate of Carbene Annelation","Angewandte Chemie, International Edition in English","1992","31","9","1236","1238","10.1002/anie.199212361","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100359","9.216","0.01","17.667","0.01","10.98","0.02","90","","107.65","0.07","90","","1703.6","","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H52 Li N3 O2 -","- C37 H52 Li N3 O2 -","- C74 H104 Li2 N6 O4 -","2","1","","Ledig, Burkhard; Marsch, Michael; Harms, Klaus; Boche, Gernot","Lithiodiphenylmethylisocyanide-(—)-sparteinebis(tetrahydrofuran): Crystal Structure of a Lithiated Isocyanide","Angewandte Chemie, International Edition in English","1992","31","1","79","80","10.1002/anie.199200791","","","","","","","","","","","","","","","","","","","","","has coordinates","177284","2020-10-21","18:00:00",""
"1507776","5.6614","0.0004","32.515","0.007","3.9525","0.0003","90","","90","","90","","727.58","0.17","298","","298","","","","","","","","","4","P n n m","-P 2 2n","58","","","","- Nb4 O17 Sr5 Ti -","- Nb4 O17 Sr5 Ti -","- Nb8 O34 Sr10 Ti2 -","2","0.25","","Drews, A R; Wong-Ng, W; Roth, R S; Vanderah, T A","PREPARATION AND CRYSTAL STRUCTURE OF Sr5TiNb4O17","Materials Research Bulletin","1996","31","","153","163","10.1016/0025-5408(95)00177-8","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509146","4.071","","4.071","","4.071","","90","","90","","90","","67.469","","","","","","","","","","","","","1","F m -3 m","-F 4 2 3","225","","","","- Ag -","- Ag -","- Ag4 -","4","0.0208333","","Williams, G.I.; Owen, E.A.","A low-temperature X-ray camera","Journal of Scientific Instruments","1954","31","","49","54","10.1088/0950-7671/31/2/305","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509709","4.873","","4.873","","4.873","","90","","90","","90","","115.715","","","","","","","","","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Ag2 S -","- Ag1.98 S -","- Ag3.96 S2 -","2","0.0208333","","Wuensch, B.J.; Cava, R.J.; Reidinger, F.","Single-crystal neutron diffraction study of the fast-ion conductor beta-Ag2 S between 186 and 325 degree","Journal of Solid State Chemistry","1980","31","","69","80","10.1016/0022-4596(80)90009-2","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510336","4.766","","3.151","","4.859","","90","","90","","90","","72.971","","","","","","","","","","","","","2","P m m a","-P 2a 2a","51","","","","- Au1.05 Cd0.95 -","- Au1.05 Cd0.95 -","- Au2.1 Cd1.9 -","2","0.25","","Miyazaki, S.; Otsuka, K.; Ohba, T.; Emura, Y.","Crystal structure of gamma-martensite in Au-47.5 at.% Cd alloy","Materials Transactions, JIM","1990","31","","12","17","10.2320/matertrans1989.31.12","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510970","5.56","","5.56","","2.98","","90","","90","","120","","79.78","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","Ce (Ru0.5 Rh2.5) B2","","- B2 Ce Rh2.5 Ru0.5 -","- B2 Ce Rh2.499 Ru0.501 -","- B2 Ce Rh2.499 Ru0.501 -","1","0.0416667","","Malik, S.K.; Reeves, M.E.; Montano, P.A.; Umarji, A.M.; Shenoy, G.K.","Valence state of Ce and the magmatism in Ce Rh3 B2","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","4728","4731","10.1103/PhysRevB.31.4728","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511021","6.841","","6.841","","6.702","","90","","90","","120","","271.628","","","","","","","","","","","","","5","P 31","P 31","144","","(Ce0.5 La0.5) (B O (Si O4))","","- B Ce0.5 La0.5 O5 Si -","- B Ce0.5 La0.5 O5 Si -","- B3 Ce1.5 La1.5 O15 Si3 -","3","1","","MacDonald, D.J.; Burns, P.C.; della Ventura, G.; Parodi, G.C.; Hawthorne, F.C.","The crystal structure of stillwellite","Canadian Mineralogist","1993","31","","147","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511294","4.6918","","5.1271","","3.1096","","90","","90","","90","","74.802","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","Pd2 B","","- B Pd2 -","- B Pd2 -","- B2 Pd4 -","2","0.25","","Tergenius, L.E.; Lundstroem, T.","The crystal structure of Pd2 B","Journal of Solid State Chemistry","1980","31","","361","367","10.1016/0022-4596(80)90100-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511666","3.202","","18.432","","8.917","","90","","90","","90","","526.275","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Co4 Nb3 B7","","- B7 Co4 Nb3 -","- B7 Co4 Nb3 -","- B28 Co16 Nb12 -","4","0.25","","Kuz'ma, Yu.B.; Aksel'rud, L.V.","Crystal structure of the boride Nb3 Co4 B7","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511675","11.014","","3.1","","12.84","","90","","90","","90","","438.401","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ho Mo3 B7","","- B7 Ho Mo3 -","- B7 Ho Mo3 -","- B28 Ho4 Mo12 -","4","0.5","","Kuz'ma, Yu.B.; Chaban, N.F.; Mikhalenko, S.I.","New borides Ln Mo3 B7 (Ln-Tb, Dy, Ho, Er, Tm) with the Y Mo3 B7 structure","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","1414","1417","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517796","4.808","0.001","4.808","0.001","16.022","0.003","90","","90","","120","","320.76","0.11","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Magnesium Calcium Carbonate (.1/.9/1)","Dolomite","- C2 Ca Mg O6 -","- C2 Ca Mg O6 -","- C6 Ca3 Mg3 O18 -","3","0.166667","","Effenberger, H.; Kirfel, A.; Will, G.","Untersuchungen zur Elektronendichteverteilung im Dolomit Ca Mg (C O3)2","TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-)","1983","31","","151","164","","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1521249","25.589","","25.589","","25.589","","90","","90","","90","","16755.6","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Na96 (Al96 Ge96 O384) (H2 O)438.08","","- Al96 Ge96 Na51.04 O822.08 -","- Al96 Ge96 Na51.04 O822.08 -","- Al96 Ge96 Na51.04 O822.08 -","1","0.0104167","","Johnson, G.M.; Parise, J.B.; Lee, Y.-J.; Tripathi, A.","Structural studies of hydrated germanium X-type zeolite via Rietveld analysis of synchrotron powder X-ray diffraction data","Microporous and Mesoporous Materials","1999","31","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","140934","2020-10-21","18:00:00",""
"1521814","21.75099","","13.73","","14.218","","90","","90","","90","","4246.08","","","","","","","","","","","","","6","P c 21 n","P -2n -2ac","33","","(Al32 P32 O128) (((C3 H7)4 N) (O H))4","","- C48 H64 Al32 N4 O132 P32 -","- C48 H64 Al32 N4 O132 P32 -","- C48 H64 Al32 N4 O132 P32 -","1","0.25","","Ramaswamy, V.; McCusker, L.B.; Baerlocher, C.","Rietveld refinement of the pure aluminophosphate (Al P O4)-40","Microporous and Mesoporous Materials","1999","31","","1","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521883","17.668","","17.881","","7.413","","90.26","","116.48","","89.61","","2096.18","","","","","","","","","","","","","7","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","(N H4)2.24 Na0.78 Ca3.54 (Al6.52 Si29.48 O72) (H2 O)21.4","","- Al6.52 Ca3.54 H51.76 N2.24 Na0.78 O93.4 Si29.48 -","- Al6.52 Ca3.54 N2.24 Na0.78 O93.4 Si29.48 -","- Al6.52 Ca3.54 N2.24 Na0.78 O93.4 Si29.48 -","1","","","Sani, A.; Ciambelli, P.; Vezzalini, G.; Rapacciuolo, M.T.","Crystal structure of hydrated and partially (N H4)-exchanged heulandite","Microporous and Mesoporous Materials","1999","31","","263","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521915","17.22699","","17.22699","","19.3064","","90","","90","","120","","4961.93","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","(K6.066 (Al6.3 Si83.7 O180)) ((C H2)12 O6)3","","- C36 H72 Al6.3 K6.066 O198 Si83.7 -","- C36 H18 Al6.3 K6.066 O198 Si83.7 -","- C36 H18 Al6.3 K6.066 O198 Si83.7 -","1","0.0277778","","Shantz, D.F.; Burton, A.; Lobo, R.F.","Synthesis, structure solution, and characterization of the aluminosilicate MCM-61: the first aluminosilicate clathrate with 18-membered rings","Microporous and Mesoporous Materials","1999","31","","61","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","142132","2020-10-21","18:00:00",""
"1522423","6.645","","6.645","","6.645","","90","","90","","90","","293.417","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Lu Pd2 Sn -","- Lu Pd2 Sn -","- Lu4 Pd8 Sn4 -","4","0.0208333","","Malik, S.K.; Umarji, A.M.; Shenoy, G.K.","Magnetic and Moessbauer studies on rare-earth-containing Heusler alloys Pd2 R Sn (R= Tb-Yb)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","6971","6975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522424","6.503","","6.503","","6.503","","90","","90","","90","","275.005","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Pd2 Sc Sn -","- Pd2 Sc Sn -","- Pd8 Sc4 Sn4 -","4","0.0208333","","Malik, S.K.; Umarji, A.M.; Shenoy, G.K.","Magnetic and Moessbauer studies on rare-earth-containing Heusler alloys Pd2 R Sn (R= Tb-Yb)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","6971","6975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522425","6.74","","6.74","","6.74","","90","","90","","90","","306.182","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Pd2 Sn Tm -","- Pd2 Sn Tm -","- Pd8 Sn4 Tm4 -","4","0.0208333","","Malik, S.K.; Umarji, A.M.; Shenoy, G.K.","Magnetic and Moessbauer studies on rare-earth-containing Heusler alloys Pd2 R Sn (R= Tb-Yb)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","6971","6975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522430","6.705","","6.705","","6.705","","90","","90","","90","","301.437","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ho Pd2 Sn -","- Ho Pd2 Sn -","- Ho4 Pd8 Sn4 -","4","0.0208333","","Malik, S.K.; Umarji, A.M.; Shenoy, G.K.","Magnetic and Moessbauer studies on rare-earth-containing Heusler alloys Pd2 R Sn (R= Tb-Yb)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","6971","6975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522489","3.86","","3.86","","6.325","","90","","90","","120","","81.614","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Ti Te","","- Te Ti -","- Te Ti -","- Te2 Ti2 -","2","0.0833333","","Matkovic, T.; Matkovic, P.","Constitutional study of the Ti, Zr and Hf tellurides","Metalurgija, Croatia","1992","31","","107","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522643","3.977","","3.977","","3.977","","90","","90","","90","","62.902","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","(Rh.33 Ru.67)3 U","","- Rh0.99 Ru2.01 U -","- Rh0.99 Ru2.01 U -","- Rh0.99 Ru2.01 U -","1","0.0208333","","Ott, H.R.; Hulliger, F.; Rudigier, H.; Fisk, Z.","Superconductivity in uranium compounds with Cu3 Au structure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","1329","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522881","3.775","","3.775","","3.775","","90","","90","","90","","53.796","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Gd (In0.1 Tl0.9)","","- Gd In0.1 Tl0.9 -","- Gd In0.1 Tl0.9 -","- Gd In0.1 Tl0.9 -","1","0.0208333","","Sekizawa, K.; Watanabe, T.; Yasukochi, K.","Strucural transformation and magnetic properties of (Gd1-x Rx) Tl and Gd (Tl1-y My) systems","Journal of Magnetism and Magnetic Materials","1983","31","","181","182","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522882","3.778","","3.778","","3.778","","90","","90","","90","","53.924","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","(Gd0.9 Y0.1) Tl","","- Gd0.9 Tl Y0.1 -","- Gd0.9 Tl Y0.1 -","- Gd0.9 Tl Y0.1 -","1","0.0208333","","Sekizawa, K.; Yasukochi, K.; Watanabe, T.","Structural transformations and magnetic properties of (Gd1-x Rx) Tl and Gd (Tl1-y My) systems","Journal of Magnetism and Magnetic Materials","1983","31","","181","182","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522918","6.084","","6.084","","6.084","","90","","90","","90","","225.2","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Hf Ni Sn -","- Hf Ni Sn -","- Hf4 Ni4 Sn4 -","4","0.0416667","","Skolozdra, R.V.; Starodynova, E.E.; Stadnyk, Yu.V.","The crystal structure and magnetic properties of Me' Me'' Sn compounds (Me'= Ti, Zr, Hf, Nb; Me''= Co, Ni)","Ukrains'kii Fizichnii Zhurnal (Ukrainian Edition)","1986","31","","1258","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522935","3.5929","","3.5929","","5.6572","","90","","90","","120","","63.244","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","(Ho Tb)","","- Ho Tb -","- Ho Tb -","- Ho Tb -","1","0.0416667","","Spedding, F.H.; Sanden, B.; Beaudry, B.J.","The Er-Y, Tb-Ho, Tb-Er, Dy-Ho, Dy-Er and Ho-Er phase systems","Journal of the Less-Common Metals","1973","31","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523063","4.32","","5.42","","9.276","","90","","90","","90","","217.192","","","","","","","","","","","","","2","A m m 2","A 2 -2","38","","","","- Rh5 V3 -","- Rh5 V3 -","- Rh10 V6 -","2","0.25","","Waterstrat, R.M.; Dickens, B.","The crystal structure of V3 Rh5","Journal of the Less-Common Metals","1973","31","","61","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523085","15.3898","","5.3795","","15.333","","90","","90.291","","90","","1269.39","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Hf3 As","","- As Hf3 -","- As Hf3 -","- As16 Hf48 -","16","2","","Willerstroem, J.O.; Rundqvist, S.; Carlsson, B.","The crystal structure of Hf3 As","Journal of Solid State Chemistry","1980","31","","227","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523377","7.013","","4.49","","5.564","","90","","90","","90","","175.201","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Pt Tb -","- Pt Tb -","- Pt4 Tb4 -","4","0.5","","Castets, A.; Gignoux, D.; Gomez-Sal, J.C.","Magnetic properties and structures of equiatomic rare earth-platinum compounds R Pt (R= Gd, Tb, Dy, Ho, Fr, Tm)","Journal of Solid State Chemistry","1980","31","","197","207","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523477","7.1","","7.1","","7.1","","90","","90","","90","","357.911","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","(Fe0.9 V0.1)2 Zr","","- Fe1.8 V0.2 Zr -","- Fe1.8 V0.2 Zr -","- Fe14.4 V1.6 Zr8 -","8","0.0416667","","Duffer, P.; Sankar, G.; Obermeyer, R.; Rao, V.U.S.; Bergner, R.L.","Superconducting and magnetic properties of Zr V2-x Fex and Hf V2-x Fex alloys","Physica Status Solidi, Sectio A: Applied Research","1975","31","","655","661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523639","4.2475","","4.2475","","4.2475","","90","","90","","90","","76.63","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ga3 U -","- Ga3 U -","- Ga3 U -","1","0.0208333","","Frost, B.R.T.; Maskrey, J.T.","The system uranium-lead","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","1329","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523784","4.0823","","4.0823","","4.0823","","90","","90","","90","","68.032","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pt3 Tb -","- Pt3 Tb -","- Pt3 Tb -","1","0.0208333","","Harris, I.R.; Gardner, W.E.; Taylor, R.H.","The constitution and structure of some rare earth-platinum alloys in the range 20-35 % rare earth","Journal of the Less-Common Metals","1973","31","","151","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523796","4.859","","4.859","","4.859","","90","","90","","90","","114.72","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pb3 Yb -","- Pb3 Yb -","- Pb3 Yb -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523797","4.191","","4.191","","4.191","","90","","90","","90","","73.613","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ga3 Lu -","- Ga3 Lu -","- Ga3 Lu -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523798","4.837","","4.837","","4.837","","90","","90","","90","","113.169","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Pb0.5 Sn0.5)3","","- La Pb1.5 Sn1.5 -","- La Pb1.5 Sn1.5 -","- La Pb1.5 Sn1.5 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Al-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523799","4.878","","4.878","","4.878","","90","","90","","90","","116.071","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","(La0.5 Th0.5) Pb3","","- La0.5 Pb3 Th0.5 -","- La0.5 Pb3 Th0.5 -","- La0.5 Pb3 Th0.5 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Al-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","144421","2020-10-21","18:00:00",""
"1523800","4.845","","4.845","","4.845","","90","","90","","90","","113.732","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Pb0.5 Tl0.5)3","","- La Pb1.5 Tl1.5 -","- La Pb1.5 Tl1.5 -","- La Pb1.5 Tl1.5 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Al-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523801","4.738","","4.738","","4.738","","90","","90","","90","","106.362","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","(La0.5 Th0.5) Sn3","","- La0.5 Sn3 Th0.5 -","- La0.5 Sn3 Th0.5 -","- La0.5 Sn3 Th0.5 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Al-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","144424","2020-10-21","18:00:00",""
"1523802","4.785","","4.785","","4.785","","90","","90","","90","","109.558","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Sn.5 Tl.5)3","","- La Sn1.5 Tl1.5 -","- La Sn1.5 Tl1.5 -","- La Sn1.5 Tl1.5 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical on number of valency electrons in Cu3Al-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523884","5.524","","5.524","","2.973","","90","","90","","90","","90.72","","","","","","","","","","","","","2","I 41/a m d :1","I 4bw 2bw -1bw","141","","(Hg Te)","","- Hg Te -","- Hg Te -","- Hg2 Te2 -","2","0.0625","","Iandelli, A.; Palenzona, A.","High-pressure-induced phase transitions of mercury chalcogenides","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","5976","5982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1523902","3.913","","3.913","","15.496","","90","","90","","90","","237.268","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Mn Pd3 -","- Mn Pd3 -","- Mn4 Pd12 -","4","0.125","","Iwasaki, H.; Okumura, K.; Ogawa, S.","Lattice modulation in the long period ordered alloys studied by X-ray diffraction. IV. Pd3 Mn","Journal of the Physical Society of Japan","1971","31","","497","505","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524187","7.2","","7.2","","7.2","","90","","90","","90","","373.248","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Co8 (Ho Tb3)","","- Co8 Ho Tb3 -","- Co8 Ho Tb3 -","- Co16 Ho2 Tb6 -","2","0.0104167","","Chachkhiani, Z.B.; Ilyushin, A.S.; Chachkhiani, L.G.; Henisch, M.; Chechernikov, V.I.","Structure, thermal expansion and magnetic properties of imtermetalloids of the system (Tb.75 Ho.25)1-x Dyx Co2","Fizika Tverdogo Tela (Leningrad) (= Solid State Physics)","1989","31","","129","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524188","7.195","","7.195","","7.195","","90","","90","","90","","372.471","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Co2 Dy -","- Co2 Dy -","- Co16 Dy8 -","8","0.0416667","","Chachkhiani, Z.B.; Ilyushin, A.S.; Chechernikov, V.I.; Henisch, M.; Chachkhiani, L.G.","Structure, thermal expansion and magnetic properties of imtermetalloids of the system (Tb.75 Ho.25)1-x Dyx Co2","Fizika Tverdogo Tela (Leningrad) (= Solid State Physics)","1989","31","","129","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524189","7.183","","7.183","","7.183","","90","","90","","90","","370.61","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","Co2 (Dy0.5 Ho0.125 Tb0.375)","","- Co2 Dy0.5 Ho0.125 Tb0.375 -","- Co2 Dy0.5 Ho0.125 Tb0.375 -","- Co16 Dy4 Ho Tb3 -","8","0.0416667","","Chachkhiani, Z.B.; Ilyushin, A.S.; Chechernikov, V.I.; Chachkhiani, L.G.; Henisch, M.","Structure, thermal expansion and magnetic properties of imtermetalloids of the system (Tb.75 Ho.25)1-x Dyx Co2","Fizika Tverdogo Tela (Leningrad) (= Solid State Physics)","1989","31","","129","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1524651","7.012","","7.012","","7.012","","90","","90","","90","","344.767","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","(Co Fe) Zr","","- Co Fe Zr -","- Co Fe Zr -","- Co8 Fe8 Zr8 -","8","0.0416667","","Kanematsu, K.","Magnetic moments in Laves phase compounds. II. Zr (Fe1-x Mnx)2 and Zr (Fe1-x Cox)2","Journal of the Physical Society of Japan","1971","31","","1355","1360","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1524842","6.692","","6.692","","6.692","","90","","90","","90","","299.687","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Er Pd2 Sn -","- Er Pd2 Sn -","- Er4 Pd8 Sn4 -","4","0.0208333","","Malik, S.K.; Umarji, A.M.; Shenoy, G.K.","Magnetic and Moessbauer studies on rare-earth-containing Heusler alloys Pd2 R Sn (R= Tb-Yb)","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","6971","6975","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525308","5.952","","5.952","","5.952","","90","","90","","90","","210.857","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Co Nb Sn -","- Co Nb Sn -","- Co4 Nb4 Sn4 -","4","0.0416667","","Skolozdra, R.V.; Stadnyk, Yu.V.; Starodynova, E.E.","The crystal structure and magnetic properties of Me' Me'' Sn compounds (Me'= Ti, Zr, Hf, Nb; Me''= Co, Ni)","Ukrains'kii Fizichnii Zhurnal (Ukrainian Edition)","1986","31","","1258","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525309","7.133","","7.133","","3.571","","90","","90","","120","","157.349","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","","","- Co Sn Zr -","- Co Sn Zr -","- Co3 Sn3 Zr3 -","3","0.25","","Skolozdra, R.V.; Stadnyk, Yu.V.; Starodynova, E.E.","The crystal structure and magnetic properties of Me' Me'' Sn compounds (Me'= Ti, Zr, Hf, Nb; Me''= Co, Ni)","Ukrains'kii Fizichnii Zhurnal (Ukrainian Edition)","1986","31","","1258","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525333","3.5773","","3.5773","","5.6182","","90","","90","","120","","62.264","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","(Dy0.515 Er0.485)","","- Dy0.515 Er0.485 -","- Dy0.515 Er0.485 -","- Dy1.03 Er0.97 -","2","0.0833333","","Spedding, F.H.; Sanden, B.; Beaudry, B.J.","The Er - Y, Tb - Ho, Tb - Er, Dy - Ho, Dy - Er and Ho - Er phase systems","Journal of the Less-Common Metals","1973","31","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","146265","2020-10-21","18:00:00",""
"1525334","3.5692","","3.5692","","6.6026","","90","","90","","120","","72.843","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","(Er0.95 Ho1.05)","","- Er0.95 Ho1.05 -","- Er0.95 Ho1.05 -","- Er0.95 Ho1.05 -","1","0.0416667","","Spedding, F.H.; Sanden, B.; Beaudry, B.J.","The Er - Y, Tb - Ho, Tb - Er, Dy - Ho, Dy - Er, and Ho - Er phase systems","Journal of the Less-Common Metals","1973","31","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","146266","2020-10-21","18:00:00",""
"1525335","3.5862","","3.5862","","5.6438","","90","","90","","120","","62.86","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","(Er0.92 Tb1.08)","","- Er0.92 Tb1.08 -","- Er0.92 Tb1.08 -","- Er0.92 Tb1.08 -","1","0.0416667","","Spedding, F.H.; Beaudry, B.J.; Sanden, B.","The Er - Y, Tb - Ho, Tb - Er, Dy - Ho, Dy - Er and Ho - Er phase systems","Journal of the Less-Common Metals","1973","31","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","146267","2020-10-21","18:00:00",""
"1525336","3.605","","3.605","","5.6604","","90","","90","","120","","63.707","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","(Er Y)","","- Er Y -","- Er0.99 Y1.01 -","- Er0.99 Y1.01 -","1","0.0416667","","Spedding, F.H.; Sanden, B.; Beaudry, B.J.","The Er - Y, Tb - Ho, Tb - Er, Dy - Ho, Dy - Er and Ho - Er phase systems","Journal of the Less-Common Metals","1973","31","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525347","7.915","","7.915","","7.915","","90","","90","","90","","495.853","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Co2 (Ho0.5 Y0.5)","","- Co2 Ho0.5 Y0.5 -","- Co2 Ho0.5 Y0.5 -","- Co16 Ho4 Y4 -","8","0.0416667","","Steiner, W.; Ortbauer, H.","Kobaltmoment in Hox Y1-x Co2 und Hox Y1-x (Fe.1 Co.9)","Physica Status Solidi, Sectio A: Applied Research","1975","31","","K119","K123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525348","7.23","","7.23","","7.23","","90","","90","","90","","377.933","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","(Co1.8 Fe0.2) (Ho0.5 Y0.5)","","- Co1.8 Fe0.2 Ho0.5 Y0.5 -","- Co1.8 Fe0.2 Ho0.5 Y0.5 -","- Co14.4 Fe1.6 Ho4 Y4 -","8","0.0416667","","Steiner, W.; Ortbauer, H.","Kobaltmoment in Hox Y1-x Co2 und Hox Y1-x (Fe.1 Co.9)","Physica Status Solidi, Sectio A: Applied Research","1975","31","","K119","K123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1525349","7.24","","7.24","","7.24","","90","","90","","90","","379.503","","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","(Co1.8 Fe0.2) Y","","- Co1.8 Fe0.2 Y -","- Co1.8 Fe0.2 Y -","- Co14.4 Fe1.6 Y8 -","8","0.0416667","","Steiner, W.; Ortbauer, H.","Kobaltmoment in Hox Y1-x Co2 und Hox Y1-x (Fe0.1 Co0.9)","Physica Status Solidi, Sectio A: Applied Research","1975","31","","K119","K123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525441","6.704","","6.704","","6.704","","90","","90","","90","","301.302","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Co2 Ti -","- Co2 Ti -","- Co16 Ti8 -","8","0.0416667","","Wallbaum, H.J.; Witte, H.","Die Kristallstruktur des Ti Co2","Zeitschrift fuer Metallkunde","1939","31","","185","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525492","5.09","","5.09","","12.52","","90","","90","","120","","280.912","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Co2 Tb -","- Co2 Tb -","- Co12 Tb6 -","6","0.166667","","Yoshimoto, N.; Sakurai, J.; Komura, Y.","X-ray diffraction study on crystal deformation of Tb Co2","Journal of Magnetism and Magnetic Materials","1983","31","","137","139","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526561","7.4512","","14.112","","18.838","","90","","90","","90","","1980.84","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","Na4.26 (Al4.26 Si31.74 O72)","","- Al4.256 O72 Si31.744 -","- Al4.256 O72 Si31.744 -","- Al4.256 O72 Si31.744 -","1","0.125","","Kato, M.; Itabashi, K.","Structure refinement of Na-ferrierite by the space group determined from the ordered distribution of Al atoms in its framework","X-sen Bunseki no Shinpo","2000","31","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","147760","2020-10-21","18:00:00",""
"1527081","7.1067","","7.1067","","17.0867","","90","","90","","120","","747.351","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","Pd15 P2","","- P2 Pd15 -","- P2 Pd15 -","- P6 Pd45 -","3","0.166667","","Andersson, Y.","The crystal structure of Pd15 P2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","354","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","148386","2020-10-21","18:00:00",""
"1527138","5.464","","5.464","","5.464","","90","","90","","90","","163.129","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Sc As","","- As Sc -","- As Sc -","- As4 Sc4 -","4","0.0208333","","Berger, R.","Crystallographic data on new arsenides and antimonides of titanium and scandium","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","514","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527139","5.8517","","5.8517","","5.8517","","90","","90","","90","","200.376","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Sb Sc -","- Sb Sc -","- Sb4 Sc4 -","4","0.0208333","","Berger, R.","Crystallographic data on new arsenides and antimonides of titanium and scandium","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","514","516","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527140","10.2173","","8.3281","","7.1459","","90","","90","","90","","608.05","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Sb3 Ti5 -","- Sb3 Ti5 -","- Sb12 Ti20 -","4","0.5","","Berger, R.","Structure refinement of Ti5 Sb3 from single-crystal data","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","889","890","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527224","6.57","","12.76","","15.028","","90","","90.04","","90","","1259.84","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Eu2 Sb3 -","- Eu2 Sb3 -","- Eu16 Sb24 -","8","2","","Chapuis, G.; Hulliger, F.; Schmelczer, R.","The Crystal Structure and Some Properties of Eu2 Sb3","Journal of Solid State Chemistry","1980","31","","59","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527401","5.821","","5.821","","10.437","","90","","90","","120","","306.268","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","K4 Zr5 O12","","- K4 O12 Zr5 -","- K4 O12 Zr5 -","- K4 O12 Zr5 -","1","0.0833333","","Gatehouse, B.M.; Nesbit, M.C.","The Crystal Structure of the 2:5 phase in the K2 O - Zr O2 System: K4 Zr5 O12, a Compound with Octahedral and Trigonal Prismatic Zirconium(IV) Coordination","Journal of Solid State Chemistry","1980","31","","53","58","","","","","","","","","","","","","","","","","","","","","","has coordinates","148966","2020-10-21","18:00:00",""
"1527490","4.714","","4.714","","4.714","","90","","90","","90","","104.754","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Sn3 Th -","- Sn3 Th -","- Sn3 Th -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperatures on number o valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527655","7.861","","7.861","","6.726","","90","","90","","120","","359.951","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cd Cs Br3","","- Br3 Cd Cs -","- Br3 Cd Cs -","- Br6 Cd2 Cs2 -","2","0.0833333","","Knakkergaard Moeller, C.","About the crystal structure of cesium cadmium tribromide and some observations on crystals of cesium cadmium trichloride","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","669","672","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527673","12.933","","7.334","","10.811","","90","","91.68","","90","","1024.99","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pr H3 (Se O3)2 (Se2 O5)","","- H3 O11 Pr Se4 -","- O11 Pr Se4 -","- O44 Pr4 Se16 -","4","1","","Koskenlinna, M.; Valkonen, J.","The crystal structure of Pr H3 (Se O3)2 (Se2 O5), a compound with selenite and diselenite groups","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","457","460","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527674","7.751","","10.33","","13.429","","90","","92.74","","90","","1074","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Mn2 (Se O3)3 (H2 O)3","","- H6 Mn2 O12 Se3 -","- Mn2 O12 Se3 -","- Mn8 O48 Se12 -","4","1","","Koskenlinna, M.; Valkonen, J.","Jahn-Teller distortions in the structure of manganese(III) selenite trihydrate, Mn2 (Se O3)3 (H2 O)3","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","611","614","","","","","","","","","","","","","","","","","","","","","","has coordinates","149361","2020-10-21","18:00:00",""
"1527675","7.451","","12.583","","7.575","","90","","92.82","","90","","709.341","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Mn H (Se O3) (Se2 O5)","","- H Mn O8 Se3 -","- Mn O8 Se3 -","- Mn4 O32 Se12 -","4","1","","Koskenlinna, M.; Valkonen, J.","Crystal structure of manganese(III) hydrogen selenite diselenite, Mn H (Se O3) (Se2 O5)","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","638","640","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527676","13.179","","5.826","","4.933","","90","","90","","90","","378.76","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Mn (Se O3) (D2 O)","","- D2 Mn O4 Se -","- Mn O4 Se -","- Mn4 O16 Se4 -","4","0.5","","Koskenlinna, M.; Valkonen, J.","The crystal structure of manganese(II) selenite monodeuterate","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","752","754","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527682","7.2","","7.2","","4.21","","90","","90","","90","","218.246","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(N D4)2 (Pd Cl4)","","- Cl4 D8 N2 Pd -","- Cl4 D8 N2 Pd -","- Cl4 D8 N2 Pd -","1","0.0625","","Krebs Larsen, F.; Berg, R.W.","A neutron diffraction study of the crystal structure of deuterated ammonium tetrachloropalladate(II) at low and ambient temperatures","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","375","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527731","14.5994","0.0017","11.0064","0.0004","5.6601","0.0005","90","","90","","90","","909.504","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","cerium(IV) sulfate tetrahydrate","","- Ce H8 O12 S2 -","- Ce H8 O12 S2 -","- Ce4 H32 O48 S8 -","4","0.5","","Lindgren, O.","The crystal structure of cerium(IV) sulfate tetrahydrate, Ce(SO4)2 . (H2O)4","Acta Chemica Scandinavica, Series A: Physical and Inorganic Chemistry","1977","31","","453","456","10.3891/acta.chem.scand.31a-0453","","","","","","","","","","","","","","","","","","","","","has coordinates","303120","2025-10-31","16:25:09",""
"1527732","7.0134","","7.0134","","12.92","","90","","90","","120","","550.364","","","","","","","","","","","","","5","P 31 2 1","P 31 2""","152","","Ce Na (S O4)2 (H2 O)","","- Ce H2 Na O9 S2 -","- Ce Na O9 S2 -","- Ce3 Na3 O27 S6 -","3","0.5","","Lindgren, O.","The crystal structure of sodium cerium(III) sulfate hydrate, Na Ce (S O4)2 (H2 O)","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","591","594","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527788","14.03","","3.481","","6.28","","90","","118.96","","90","","268.354","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Cr0.5 Nb Se2 -","- Cr0.5 Nb Se2 -","- Cr2 Nb4 Se8 -","4","0.5","","Meerschaut, A.; Spiesser, M.; Rouxel, J.; Gorochov, O.","Structure cristalline et proprietes physiques electriques et magnetiques des phases M0.5 Nb Se2 (M= Ti, V, Cr)","Journal of Solid State Chemistry","1980","31","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527881","4.732","","6.037","","5.204","","90","","90","","90","","148.663","","","","","","","","","","","","","2","P b c n","-P 2n 2ab","60","","Mo2 C","","- C Mo2 -","- C1.02 Mo2 -","- C4.08 Mo8 -","4","0.5","","Norlund Christensen, A.","A neutron diffraction investigation on a crystal of alpha-Mo2 C","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","509","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527902","3.977","","3.977","","3.977","","90","","90","","90","","62.902","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ru3 U -","- Ru3 U -","- Ru3 U -","1","0.0208333","","Ott, H.R.; Rudigier, H.; Hulliger, F.; Fisk, Z.","Superconductivity in uranium compounds with Cu3 Au structure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","1329","1333","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528055","5.002","","5.002","","5.002","","90","","90","","90","","125.15","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Bk O -","- Bk O -","- Bk4 O4 -","4","0.0208333","","Seleznev, A.G.; Radchenko, V.M.; Ryabinin, M.A.; Droznik, R.R.; Shushakov, V.D.; Lebedeva, L.S.; Vasil'ev, V.Ya.","Preparation of rare metallic actinides ((248)Cm, (249)Bk, (249)Cf) and investigation of their crystal structure","Radiokhimiya","1989","31","","20","25","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528096","9.231","","9.231","","9.231","","90","","90","","90","","786.586","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","(N H4)3 (Ti F6.98)","","- F6.98 H12 N3 Ti -","- F6.984 H12.002 N3 Ti -","- F27.936 H48.008 N12 Ti4 -","4","0.0208333","","Stomberg, R.; Svensson, I.B.","The disordered structure of ammonium pentafluoroperoxotitanate(IV), (N H4)3 (Ti F5 (O2))","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","635","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528289","11.9","","3.671","","10.122","","90","","100.87","","90","","434.245","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","V12 O26","","- O26 V12 -","- O26 V12 -","- O26 V12 -","1","0.125","","Aebi, F.","Phasenuntersuchungen im System Vanadin-Sauerstoff und die Krystallstruktur von V12O26","Helvetica Chimica Acta","1948","31","","8","21","","","","","","","","","","","","","","","","","","","","","","has coordinates","150304","2020-10-21","18:00:00",""
"1528290","6.056","","6.139","","5.64","","90","","93.5","","90","","209.292","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Cu Br2 (Cu (O H)2)3","","- Br2 Cu4 H6 O6 -","- Br2 Cu4 O6 -","- Br2 Cu4 O6 -","1","0.25","","Aebi, F.","Die Kristallstruktur des basischen Kupferbromids Cu Br2 * 3(Cu (O H)2)","Helvetica Chimica Acta","1948","31","","369","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528685","14.7514","","13.0827","","7.5648","","90","","111.997","","90","","1353.64","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Ca Al2 Si4 O12 (H2 O)3.02","","- Al2 Ca H6.04 O15.02 Si4 -","- Al2 Ca O15.02 Si4 -","- Al8 Ca4 O60.08 Si16 -","4","0.5","","Lee, Y.; Hriljac, J.A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite","Physics and Chemistry of Minerals (Germany)","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529103","9.4128","","9.4128","","3.3361","","90","","90","","90","","295.581","","","","","","","","","","","","","2","P 4/m","-P 4","83","","V3 As2","","- As2 V3 -","- As2 V3 -","- As8 V12 -","4","0.5","","Berger, R.","The crystal structure of V3 As2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","287","291","","","","","","","","","","","","","","","","","","","","","","has coordinates","152166","2020-10-21","18:00:00",""
"1529804","5.391","","5.391","","8.748","","90","","90","","120","","220.18","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Zr Mn2 D2.748","","- D2.748 Mn2 Zr -","- D2.748 Mn2 Zr -","- D10.992 Mn8 Zr4 -","4","0.166667","","Didisheim, J.J.; Shaltiel, D.; Yvon, K.; Fischer, P.","The distribution of the deuterium atoms in the deuterated hexagonal laves-phase Zr Mn2 D3","Solid State Communications","1979","31","","47","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529925","7.047","","10.4","","8.384","","90","","107.29","","90","","586.688","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K3 (Fe (C N)6)","","- C6 Fe K3 N6 -","- C6 Fe K3 N6 -","- C12 Fe2 K6 N12 -","2","0.5","","Figgis, B.N.; Skelton, B.W.; White, A.H.","Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)","Australian Journal of Chemistry","1978","31","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529926","13.422","","10.399","","8.381","","90","","90","","90","","1169.78","","","","","","","","","","","","","4","P n c a","-P 2a 2n","60","","K3 (Fe (C N)6)","","- C6 Fe K3 N6 -","- C6 Fe K3 N6 -","- C24 Fe4 K12 N24 -","4","0.5","","Figgis, B.N.; Skelton, B.W.; White, A.H.","Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)","Australian Journal of Chemistry","1978","31","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530643","7.608","","7.608","","7.296","","90","","90","","90","","422.305","","","","","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","Rb (H2 P O4)","","- H2 O4 P Rb -","- O4 P Rb -","- O16 P4 Rb4 -","4","0.25","","Rez, I.S.; Pakhomov, V.I.; Sil'nitskaya, G.B.; Fedorov, P.M.","Some problems of the crystal chemistry of the crystals of the type K H2 P O4","Izvestiya Akademii Nauk SSSR, Seriya Fizicheskaya","1967","31","","1082","1085","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530818","8.9834","","8.9834","","22.8658","","90","","90","","120","","1598.08","","","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","Na2.49 (Zr1.8 Sc0.2) (Si O4)1.29 (P O4)1.71","","- Na2.49 O12 P1.71 Sc0.2 Si1.29 Zr1.8 -","- Na2.49 O12 P1.71 Sc0.2 Si1.29 Zr1.8 -","- Na14.94 O72 P10.26 Sc1.2 Si7.74 Zr10.8 -","6","0.166667","","Squattrito, P.J.; Volin, K.; Rudolf, P.R.; Hinson, P.G.; Clearfield, A.; Jorgensen, J.D.","Sodium and oxygen disorder in a scandium-substituted Nasicon: A time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12","Solid State Ionics","1988","31","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","156032","2020-10-21","18:00:00",""
"1530819","8.9863","","8.9863","","23.0161","","90","","90","","120","","1609.62","","","","","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12","","- Na2.5 O12 P1.7 Sc0.2 Si1.3 Zr1.8 -","- Na2.52 O12 P1.71 Sc0.2 Si1.29 Zr1.8 -","- Na15.12 O72 P10.26 Sc1.2 Si7.74 Zr10.8 -","6","0.166667","","Squattrito, P.J.; Rudolf, P.R.; Jorgensen, J.D.; Clearfield, A.; Hinson, P.G.; Volin, K.","Sodium and oxygen disorder in a scandium-substituted Nasicon: A time-of-flight neutron powder diffraction study of Na2.5 Zr1.8 Sc0.2 Si1.3 P1.7 O12","Solid State Ionics","1988","31","","31","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","156033","2020-10-21","18:00:00",""
"1531146","19.765","","7.54","","8.384","","90","","98.87","","90","","1234.51","","","","","","","","","","","","","6","P 1 2/m 1","-P 2y","10","","Sr (Fe (C N)5 (N O)) (H2 O)4","","- C5 H8 Fe N6 O5 Sr -","- C5 H8 Fe N6 O5 Sr -","- C20 H32 Fe4 N24 O20 Sr4 -","4","1","","Chevrier, G.; Navaza, A.; Aymonino, P. J.; Kiat, J. M.; Zuriaga, M. J.; Martin, C. A.; Monti, G. A.; Güida, J. A.; Lanzelotti, P. L.","Low temperature phases of strontium nitroprusside tetrahydrate (Sr(Fe(CN)~5~NO) * 4(H~2~O)). Refinement of the neutron structure at 60 K","Journal of Chemical Crystallography","2001","31","11-12","491","500","10.1023/A:1015707632369","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531352","11.418","","6.447","","5.27","","90","","90","","90","","387.934","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Na Ho (Ge O4)","","- Ge Ho Na O4 -","- Ge Ho Na O4 -","- Ge4 Ho4 Na4 O16 -","4","0.5","","Emirdag-Eanes, M.; Krawiec, M.; Kolis, J. W.","Hydrothermal synthesis and structural characterization of NaLnGeO~4~ (Ln = Ho, Er, Tb, Tm, Yb, Lu) family of lanthanide germanates","Journal of Chemical Crystallography","2002","31","5","281","285","10.1023/A:1014378729117","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532314","16.308","","16.308","","15.418","","90","","90","","90","","4100.43","","","","","","","","","","","","","6","I 4/m","-I 4","87","","Na16 (Fe (C N)5 C O)4 (Fe (C N)6) (H2 O)32","","- C30 H64 Fe5 N26 Na16 O36 -","- C30 Fe5 N26 Na16 O36 -","- C60 Fe10 N52 Na32 O72 -","2","0.125","","Soria, D. B.; Piro, O. E.; Varetti, E. L.; Aymonino, P. J.","X-ray diffraction and DFT structures of the pentacyanocarbonylferrate(3-) ion","Journal of Chemical Crystallography","2001","31","11-12","471","477","10.1023/A:1015659014622","","","","","","","","","","","","","","","","","","","","","has coordinates","174914","2020-10-21","18:00:00",""
"1533704","7.8304","","7.8304","","7.8361","","90","","90","","120","","416.101","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Co3 W10 C3.4","","- C3.4 Co3 W10 -","- C3.415 Co3 W10 -","- C6.83 Co6 W20 -","2","0.0833333","","Harsta, A.; Rundqvist, S.; Johansson, T.; Thomas, J.O.","A neutron powder diffraction study of the kappa-phase in the Co-W-C system","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","260","264","","","","","","","","","","","","","","","","","","","","","","has coordinates","159973","2020-10-21","18:00:00",""
"1533747","9.5031","","9.5031","","4.8255","","90","","90","","90","","435.786","","","","","","","","","","","","","2","I 4/m c m","-I 4 2c","140","","V5 As2.74","","- As2.74 V5 -","- As2.743 V5 -","- As10.972 V20 -","4","0.125","","Berger, R.","Crystal structure refinement of alpha-V5 As3","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","223","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","160018","2020-10-21","18:00:00",""
"1534049","15.583","","13.448","","6.748","","90","","90","","95.39","","1407.86","","","","","","","","","","","","","4","A 1 1 2/a","-A 2a","15","","Ce2 (O H)2 (S O4)3 (H2 O)4","","- Ce2 H10 O18 S3 -","- Ce2 O18 S3 -","- Ce8 O72 S12 -","4","0.5","","Lindgren, O.","The crystal structure of a dimeric cerium(IV) sulfate, Ce2 (O H)2 (S O4)3 (H2 O)4","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","163","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534050","6.5865","","10.6716","","5.6699","","90","","92.59","","90","","398.122","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Ce (Cr O4)2 (H2 O)2","","- Ce Cr2 H4 O10 -","- Ce Cr2 O10 -","- Ce2 Cr4 O20 -","2","0.5","","Lindgren, O.","The crystal structure of cerium(IV) dichromate dihydrate, Ce (Cr O4)2 (H2 O)2","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","167","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534062","9.866","","11.502","","9.152","","90","","98.3","","90","","1027.68","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na4 (Cr (C N)6) (H2 O)10","","- C6 H20 Cr N6 Na4 O10 -","- C6 Cr N6 Na4 O10 -","- C12 Cr2 N12 Na8 O20 -","2","0.5","","Ljungstroem, E.","The crystal structure of sodium hexacyanochromate(II) decahydrate, Na4 (Cr (C N)6) (H2 O)10","Acta Chemica Scandinavica, Series A: (28,1974-)","1977","31","","104","108","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535811","5.579","","5.579","","7.15","","90","","90","","120","","192.73","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ca2 (Si O4)","","- Ca2 O4 Si -","- Ca2 O4 Si -","- Ca4 O8 Si2 -","2","0.0833333","","Udagawa, S.; Urabe, K.; Yano, T.","Crystal structure analysis of alpha-Ca2 Si O4","Semento Hijutsu Nempo","1977","31","","26","29","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535914","10.099","","10.099","","7.4","","90","","90","","120","","653.611","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Pb5 (Ge O4) (V O4)2","","- Ge O12 Pb5 V2 -","- Ge0.999 O12 Pb5 V2.001 -","- Ge1.998 O24 Pb10 V4.002 -","2","0.166667","","Ivanov, S.A.","Full profile refinement of Pb5(GeO4)(VO4)2 crystal structure","Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)","1990","31","","80","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535951","3.816","","3.816","","12.343","","90","","90","","90","","179.737","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","La Ca (Ga O4)","","- Ca Ga La O4 -","- Ca Ga La O4 -","- Ca2 Ga2 La2 O8 -","2","0.0625","","Vasylechko, L.O.; Fedorchuk, A.A.; Matkovskii, A.O.; Savitskii, D.I.; Ubizskii, S.B.","Crystal structure of La Ca Ga O4 and Nd Sr Ga O4","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","1234","1237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535954","3.8151","","3.8151","","12.523","","90","","90","","90","","182.272","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Nd Sr (Ga O4)","","- Ga Nd O4 Sr -","- Ga Nd O4 Sr -","- Ga2 Nd2 O8 Sr2 -","2","0.0625","","Vasylechko, L.O.; Savitskii, D.I.; Fedorchuk, A.A.; Ubizskii, S.B.; Matkovskii, A.O.","Crystal structure of La Ca Ga O4 and Nd Sr Ga O4","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","1234","1237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536528","4.523","","4.523","","4.523","","90","","90","","90","","92.529","","","","","","","","","","","","","2","P 21 3","P 2ac 2ab 3","198","","Si5 C3","","- C3 Si5 -","- C2.96 Si5.04 -","- C2.96 Si5.04 -","1","0.0833333","","Khaenko, B.V.; Prilutskii, E.V.; Krainikov, A.V.; Mikhailik, A.A.; Karpets, M.V.","State and crystal structure of the products of interaction between Si C and Si O2","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","327","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","164268","2020-10-21","18:00:00",""
"1536568","10.378","","6.759","","6.677","","90","","93.739","","90","","467.361","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs H C2 O4","","- C2 H Cs O4 -","- C2 H Cs O4 -","- C8 H4 Cs4 O16 -","4","1","","Kholodkovskaya, L.N.; Tskhelashvili, N.B.; Trunov, V.K.","Crystal structures of cesium hydridooxalate and cesium oxalate dihydrate","Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)","1990","31","","154","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:10",""
"1536571","6.2094","","11.052","","6.195","","90","","112.87","","90","","391.719","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs2 C2 O4 (H2 O)2","","- C2 H4 Cs2 O6 -","- C2 H4 Cs2 O6 -","- C4 H8 Cs4 O12 -","2","0.5","","Kholodkovskaya, L.N.; Tskhelashvili, N.B.; Trunov, V.K.","Crystal structure of cesium hydridooxalate and cesium oxalate dihydrate","Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii)","1990","31","","154","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","164324","2020-10-21","18:00:00",""
"1536595","5.098","","5.098","","4.049","","90","","90","","120","","91.134","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Yb0.5 Fe3 Ge3","","- Fe3 Ge3 Yb0.5 -","- Fe3 Ge2.998 Yb0.501 -","- Fe3 Ge2.998 Yb0.501 -","1","0.0416667","","Dzyanyi, R.B.; Bodak, O.I.; Aksel'rud, L.G.; Pavlyuk, V.V.","Crystal structure of Yb M6 Ge6 (M-Fe, Co, Mn) compounds","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","987","987","","","","","","","","","","","","","","","","","","","","","","has coordinates","164363","2020-10-21","18:00:00",""
"1536598","7.2279","","7.2279","","3.8764","","90","","90","","90","","202.513","","","","","","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","Yb Fe4 Ge2","","- Fe4 Ge2 Yb -","- Fe4 Ge2 Yb -","- Fe8 Ge4 Yb2 -","2","0.125","","Dzyanyi, R.B.; Bodak, O.I.; Aksel'rud, L.G.","Crystal structure of Yb Fe4 Ge2","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","988","989","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536600","4.186","","4.186","","6.988","","90","","90","","120","","106.043","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Yb Cu Ge","","- Cu Ge Yb -","- Cu Ge Yb -","- Cu2 Ge2 Yb2 -","2","0.0833333","","Dzyanyi, R.B.; Bodak, O.I.; Aksel'rud, L.G.","Crystal structure of Yb Cu Ge compound","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","990","990","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536750","7.509","","9.911","","8.224","","90","","106.03","","90","","588.246","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Rb (Ni0.35 Cr0.30 Ti0.35) (P2 O7)","","- Cr0.3 Ni0.35 O7 P2 Rb Ti0.35 -","- Cr0.3 Ni0.35 O7 P2 Rb Ti0.35 -","- Cr1.2 Ni1.4 O28 P8 Rb4 Ti1.4 -","4","1","","Yakubovich, O.V.; Dimitrova, O.V.; Strelkova, E.E.","Preparation and structure of a new diphosphate Rb (Ni0.35 Cr0.30 Ti0.35) P2 O7","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","384","388","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536777","5.047","","5.047","","4.73","","90","","90","","120","","104.342","","","","","","","","","","","","","3","P -3 1 m","-P 3 2","162","","Al (O H)3","","- Al H3 O3 -","- Al O3 -","- Al2 O6 -","2","0.166667","","Yamaguchi, Goro; Sakamoto, Kenichi","Crystal structure of bayerite","Bulletin of the Chemical Society of Japan","1958","31","1","140","141","10.1246/bcsj.31.140","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537155","6.176","","6.176","","3.204","","90","","90","","120","","105.837","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Ni6 Ge2.06 P0.94","","- Ge2.06 Ni6 P0.94 -","- Ge2.07 Ni6 P0.93 -","- Ge2.07 Ni6 P0.93 -","1","0.0833333","","Kuz'ma, Yu.B.; Orishchin, S.V.; Kondrishin, U.I.; Klypych, O.L.","The system Ni-Ge-P","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1995","31","","168","172","","","","","","","","","","","","","","","","","","","","","","has coordinates","165178","2020-10-21","18:00:00",""
"1537203","11.734","","15.695","","9.268","","90","","132","","90","","1268.43","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","K Ce2 (S O4)4","","- Ce2 K O16 S4 -","- Ce2 K O16 S4 -","- Ce8 K4 O64 S16 -","4","1","","Kuznetsov, V.Ya.; Dikareva, L.M.; Porai-Koshits, M.A.; Rogachev, D.L.","Structure of K Ce(III) Ce(IV) (S O4)4","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1990","31","","14","18","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537353","10.86","","13.6","","6.39","","90","","90","","90","","943.777","","","","","","","","","","","","","3","F m m m","-F 2 2","69","","","","- Cs2 Pt3 S4 -","- Cs2 Pt3 S4 -","- Cs8 Pt12 S16 -","4","0.125","","Guenther, O.; Bronger, W.","Cs2 Pt3 S4 und Rb2 Pt3 S4, Synthese und Struktur","Journal of the Less-Common Metals","1973","31","","255","262","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537542","12.06","","10.3","","6.85","","90","","105.6","","90","","819.549","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Co (N H3)3 (N O2)2 Br","","- Br Co H9 N5 O4 -","- Br Co H9 N5 O4 -","- Br4 Co4 H36 N20 O16 -","4","1","","Komiyama, Yoshimichi","The Crystal Structure of Bromodinitro-triammine-cobalt(III)","Bulletin of the Chemical Society of Japan","1958","31","1","26","31","10.1246/bcsj.31.26","","","","","","","","","","","","","","","","","","","","","has coordinates","186592","2020-10-21","18:00:00",""
"1537657","7.743","","7.743","","7.743","","90","","90","","90","","464.224","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- La Os2 -","- La Os2 -","- La8 Os16 -","8","0.0416667","","Cannon, J.F.; Robertson, D.L.; Lawson, A.C.; Hall, H.T.","The effect of high pressure on the crystal structure of La Os2 and Ce Os2","Journal of the Less-Common Metals","1973","31","","174","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538102","4.595","","4.595","","4.595","","90","","90","","90","","97.019","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In3 U -","- In3 U -","- In3 U -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538104","4.799","","4.799","","4.799","","90","","90","","90","","110.523","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- La Tl3 -","- La Tl3 -","- La Tl3 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538252","6.39","","10.84","","13.3","","90","","90","","90","","921.259","","","","","","","","","","","","","3","F m m m","-F 2 2","69","","","","- Pt3 Rb2 S4 -","- Pt3 Rb2 S4 -","- Pt12 Rb8 S16 -","4","0.125","","Gunther, O.; Bronger, W.","Cs2 Pt3 S4 und Rb2 Pt3 S4, Synthese und Struktur","Journal of the Less-Common Metals","1973","31","","255","255","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538296","5.843","","5.843","","5.843","","90","","90","","90","","199.484","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Hg Te -","- Hg Te -","- Hg4 Te4 -","4","0.0208333","","Huang Tzuen-Luh; Ruoff, A.L.","Pressure-induced phase transitions of mercury chalcogenides","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","5976","5982","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538898","2.953","","2.953","","2.953","","90","","90","","90","","25.751","","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","","","","- Mg -","- Mg -","- Mg2 -","2","0.0208333","","Olijnyk, H.; Holzapfel, W.B.","High-pressure structural phase transition in Mg","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1985","31","","4682","4683","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:10",""
"1539263","3.897","","3.897","","3.897","","90","","90","","90","","59.182","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pt3 Ti -","- Pt3 Ti -","- Pt3 Ti -","1","0.0208333","","Wallbaum, H.J.","Zur Legierungschemie der Uebergangsmetalle","Naturwissenschaften","1943","31","","91","91","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539409","5.921","","5.921","","5.921","","90","","90","","90","","207.58","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ni Sn Ti -","- Ni Sn Ti -","- Ni4 Sn4 Ti4 -","4","0.0208333","","Skolozdra, R.V.; Stadnyk, Yu.V.; Starodynova, E.E.","The crystal structure and magnetic properties of Me' Me'' Sn compounds (Me'= Ti, Zr, Hf, Nb; Me''= Co, Ni)","Ukrains'kii Fizichnii Zhurnal (Ukrainian Edition)","1986","31","","1258","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539412","6.099","","6.099","","6.099","","90","","90","","90","","226.869","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Ni Sn Zr -","- Ni Sn Zr -","- Ni4 Sn4 Zr4 -","4","0.0416667","","Skolozdra, R.V.; Stadnyk, Yu.V.; Starodynova, E.E.","The crystal structure and magnetic properties of Me' Me''' Sn compounds (Me'= Ti, Zr, Hf, Nb; Me'''= Co, Ni)","Ukrains'kii Fizichnii Zhurnal (Ukrainian Edition)","1986","31","","1258","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539828","7.439","","7.439","","7.439","","90","","90","","90","","411.665","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- V2 Zr -","- V2 Zr -","- V16 Zr8 -","8","0.0416667","","Duffer, P.; Bergner, R.L.; Sankar, S.G.; Rao, V.U.S.; Obermeyer, R.","Superconducting and magnetic properties of Zr V2-x Fex and Hg V2-x Fex alloys","Physica Status Solidi, Sectio A: Applied Research","1975","31","","655","661","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539973","5.35","","5.35","","5.35","","40.47","","40.47","","40.47","","58.177","","","","","","","","","","","","","3","R -3 m :R","-P 3* 2","166","","Ca (C N2)","","- C Ca N2 -","- C Ca N2 -","- C Ca N2 -","1","0.0833333","","Yamamoto, Yuzo; Kinoshita, Kyoji; Tamaru, Kenzi; Yamanaka, Teruko","Redetermination of the crystal structure of calcium cyanamide","Bulletin of the Chemical Society of Japan","1958","31","4","501","502","10.1246/bcsj.31.501","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:10",""
"1540061","4.748","","4.748","","4.748","","90","","90","","90","","107.037","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Th Tl3 -","- Th Tl3 -","- Th Tl3 -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540062","4.678","","4.678","","4.678","","90","","90","","90","","102.372","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Tl3 Y -","- Tl3 Y -","- Tl3 Y -","1","0.0208333","","Havinga, E.E.; Damsma, H.; van Maaren, M.H.","Oscillatory dependence of superconductive critical temperature on number of valency electrons in Cu3 Au-type alloys","Journal of Physics and Chemistry of Solids","1970","31","","2653","2662","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540316","17.949","","12.223","","8.029","","90","","90","","90","","1761.49","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","","","- Ni18 Sc6 Si11 -","- Ni18 Sc6 Si11 -","- Ni72 Sc24 Si44 -","4","0.25","","Kotur, B.Ya.; Gladyshevskii, E.I.; Sikiritsa, M.","Structure of the silicide Sc6 Ni18 Si11 - a new structural type of intermetallic compound","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","470","472","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540787","6.679","","6.341","","7.672","","90","","130.32","","90","","247.734","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Ga La Ni -","- Ga La Ni -","- Ga4 La4 Ni4 -","4","1","","Yarmolyuk, Ya.P.; Grin', Yu.N.; Vasilechko, L.O.; Bel'skii, V.K.","Crystal structure of the compound La Ga Ni","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","106","108","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540788","13.784","","13.784","","4.229","","90","","90","","90","","803.504","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","","","- Al7 Co6 Pr7 -","- Al7 Co6 Pr7 -","- Al14 Co12 Pr14 -","2","0.125","","Yarmolyuk, Ya.P.; Zarechnyuk, O.S.; Aksel'rud, L.G.; Rozhdestvenskaya, I.V.; Rykhal', R.M.","Crystal structure of Pr7 Co6 Al7 - a representative of the family R7 Co6 Al7 (R= Pr, Nd, Sm)","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","230","231","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1540973","5.9366","","5.9366","","14.543","","90","","90","","120","","443.875","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","(Co Fe2) O4","","- Co Fe2 O4 -","- Co0.9999 Fe2.0001 O4 -","- Co5.9994 Fe12.0006 O24 -","6","0.166667","","Shin, H.-S.; Lee, J.-H.; Kwon, S.-J.","A study on the S-block structure in hexagonal ferrites","Yoop Hakoechi (Journal of the Korean Ceramic Society)","1994","31","","62","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541022","5.466","","7.547","","8.541","","90","","90","","90","","352.332","","","","","","","","","","","","","4","P b 21 m","P -2 -2b","26","","(N H2)2 C S","","- C H4 N2 S -","- C N2 S -","- C2 N4 S2 -","2","0.5","","Takahashi, I.","Structure of the Incommensurate Phase in Thiourea","Nippon Kessho Gakkaishi","1990","31","6","283","288","10.5940/jcrsj.31.6_283","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541033","3.893","","3.813","","11.687","","90","","90","","90","","173.482","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Y Ba2 Cu3 O6.7","","- Ba2 Cu3 O6.7 Y -","- Ba2 Cu3 O6.7 Y -","- Ba2 Cu3 O6.7 Y -","1","0.125","","Tang, Y.; Shao, M.; Zhang, W.; Liu, Z.; Zheng, X.; Lin, B.; Wu, N.; Li, J.; Li, C.; Chen, K.","Preparative and structural studies on the superconducting phase Y Ba2 Cu3 O7-d","Scientia Sinica, Series B","1988","31","","513","522","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541065","3.355","","3.355","","16.776","","90","","90","","120","","163.533","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Al3 Sc C3","","- C3 Al3 Sc -","- C3 Al3 Sc -","- C6 Al6 Sc2 -","2","0.0833333","","Tsokol', A.O.; Bodak, O.I.; Marusin, E.P.; Baivel'man, M.G.","Crystal structure of the compound Sc Al3 C3","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","467","468","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541066","8.331","","8.331","","4.0283","","90","","90","","90","","279.586","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","La2 Ni5 C3","","- C3 La2 Ni5 -","- C3 La2 Ni5 -","- C6 La4 Ni10 -","2","0.125","","Tsokol', A.O.; Bodak, O.I.; Marusin, E.P.","Crystal structure of the compound R2 Ni5 C3 (R= La, Ce)","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","39","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","172287","2020-10-21","18:00:00",""
"1541109","18.637","","4.384","","14.191","","90","","106.13","","90","","1113.83","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","La11 Ni4 Ge6","","- Ge6 La11 Ni4 -","- Ge6 La11 Ni4 -","- Ge12 La22 Ni8 -","2","0.25","","Pecharskii, V.K.; Bodak, O.I.; Bruskov, V.A.","Crystal structure of the compound La11 Ni4 Ge6 and some systematic aspects of structures with trigonal-prismatic coordination of atoms","Soviet Physics, Crystallography (= Kristallografiya)","1986","31","","184","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","172340","2020-10-21","18:00:00",""
"1541210","3.946","","3.946","","6.634","","90","","90","","120","","89.458","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Zr Te","","- Te Zr -","- Te Zr -","- Te2 Zr2 -","2","0.0833333","","Matkovic, T.; Matkovic, P.","Constitutional study of the Ti, Zr and Hf tellurides","Metalurgija, Croatia","1992","31","","107","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541211","3.763","","3.763","","3.862","","90","","90","","120","","47.36","","","","","","","","","","","","","2","P -6 m 2","P -6 2","187","","Zr Te","","- Te Zr -","- Te Zr -","- Te Zr -","1","0.0833333","","Matkovic, T.; Matkovic, P.","Constitutional study of the Ti, Zr and Hf tellurides","Metalurgija, Croatia","1992","31","","107","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541243","5.914","","5.914","","5.914","","90","","90","","90","","206.844","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Cd Pb19 S20)0.2","","- Cd0.2 Pb3.8 S4 -","- Cd0.2 Pb3.8 S4 -","- Cd0.2 Pb3.8 S4 -","1","0.00520833","","Mohammadnejad, S.; Matsushita, K.; Izutsu, T.; Ishida, A.; Fujiyasu, H.","Growth of Pb1-x-y Cdx Sry S films and SLs by hot wall epitaxy for 3 mum lasers, and their electrical properties","Japanese Journal of Applied Physics, Part 1","1992","31","","3951","3956","","","","","","","","","","","","","","","","","","","","","","has coordinates","172529","2020-10-21","18:00:00",""
"1542051","7.3","","7.3","","7.3","","90","","90","","90","","389.017","","","","","","","","","","","","","7","P -4 3 m","P -4 2 3","215","","Li4 Na K Al4 Be3 B10 O27","","- Al4 B9.9996 Be2.0004 K Li4 Na O27 -","- Al4 B9.9996 Be2.0004 K Li4 Na O27 -","- Al4 B9.9996 Be2.0004 K Li4 Na O27 -","1","0.0416667","","Strunz, H.","Die Struktur von Rhodizit","Naturwissenschaften","1943","31","","68","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542143","7.6","","7.6","","7.6","","90","","90","","90","","438.976","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Ca (Ti O3)","","- Ca O3 Ti -","- Ca O3 Ti -","- Ca8 O24 Ti8 -","8","2","","Naray-Szabo, S.","Der Strukturtyp des Perowskits (Ca Ti O3)","Naturwissenschaften","1943","31","","202","203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542144","3.89","","3.89","","3.89","","90","","90","","90","","58.864","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Fe O3)","","- Fe La O3 -","- Fe La O3 -","- Fe La O3 -","1","0.0208333","","Naray-Szabo, S.","Die Strukturen von Verbindungen A B O3. Schwesterstrukturen","Naturwissenschaften","1943","31","","466","466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542145","3.88","","3.88","","3.88","","90","","90","","90","","58.411","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La Mn O3 -","1","0.0208333","","Naray-Szabo, S.","Die Strukturen von Verbindungen A B O3. Schwesterstrukturen","Naturwissenschaften","1943","31","","466","466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542146","3.88","","3.88","","3.88","","90","","90","","90","","58.411","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","La (Cr O3)","","- Cr La O3 -","- Cr La O3 -","- Cr La O3 -","1","0.0208333","","Naray-Szabo, S.","Die Strukturen von Verbindungen A B 03. Schwesterstrukturen","Naturwissenschaften","1943","31","","466","466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1551619","18.388","0.005","10.355","0.003","19.159","0.005","90","","113.596","0.006","90","","3343","1.6","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H16 N4 O7 -","- C17 H16 N4 O7 -","- C136 H128 N32 O56 -","8","1","","MIUKURIYA, Masahiro; NAKA, Yuko; YOSHIOKA, Daisuke","Synthesis and Crystal Structure of 1,3-Bis(5-nitrosalicylideneamino)-2-propanol","X-ray Structure Analysis Online","2015","31","0","55","","10.2116/xraystruct.31.55","","","0.71073","MoKα","","0.1175","0.0909","","","0.1653","0.173","","","","","","1.318","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551620","11.8846","0.0012","14.5812","0.0011","20.235","0.002","73.031","0.005","84.561","0.006","66.297","0.005","3069.9","0.5","93","","93","","","","","","","","","6","P -1","-P 1","2","","","","- C69 H84 B3 N3 Ni O7 -","- C69 H84 B3 N3 Ni O7 -","- C138 H168 B6 N6 Ni2 O14 -","2","1","","YAMAGUCHI, Ryo; YAMASAKI, Mikio; SAKIYAMA, Hiroshi","Structure of Bis(2,2&prime;-iminodiethanol-<i>N</i>,<i>O</i>,<i>O</i>&prime;)-Nickel(II) Hydrogen-Bonded to an Organoboron Coordination Complex","X-ray Structure Analysis Online","2015","31","0","19","","10.2116/xraystruct.31.19","","","0.71075","MoKα","","0.04","0.0366","","","0.0874","0.0901","","","","","","1.043","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551621","10.1","0.0018","14.544","0.003","17.861","0.004","83.619","0.01","85.295","0.01","73.839","0.008","2500.8","0.9","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H34 Cl2 F16 N8 Pd -","- C53 H34 Cl2 F16 N8 Pd0.5 -","- C106 H68 Cl4 F32 N16 Pd -","2","1","","MORIWAKI, Kazuhiro; AKASHI, Haruo","Synthesis and Crystal Structure of 5,10,15,20-Tetrakis(2,3,5,6-tetrafluoro-4-(dimethylamino)phenyl)porphyrinato)palladium(II)-dichloromethane (1/1)","X-ray Structure Analysis Online","2015","31","0","15","","10.2116/xraystruct.31.15","","","0.71075","MoKα","","","0.0458","","","","0.1243","","","","","","1.081","","","","has coordinates","216232","2020-10-21","18:00:00",""
"1551622","8.5059","0.0015","9.8815","0.0017","11.3339","0.0019","82.916","0.003","83.819","0.003","65.595","0.003","859.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H52 N2 O10 V2 -","- C30 H52 N2 O10 V2 -","- C30 H52 N2 O10 V2 -","1","0.5","","MIKURIYA, Masahiro; FUKUTANI, Masami; YOSHIOKA, Daisuke","Synthesis and Crystal Structures of Dinuclear Dioxidovanadium(V) and Tetranuclear Oxidovanadium(IV) Complexes with 2,6-Bis(hydroxymethyl)-4-methylphenol","X-ray Structure Analysis Online","2015","31","0","33","","10.2116/xraystruct.31.33","","","0.71073","MoKα","","0.0594","0.0409","","","0.1022","0.1166","","","","","","0.93","","","","has coordinates","216233","2020-10-21","18:00:00",""
"1551623","10.731","0.014","11.373","0.015","11.558","0.015","104.28","0.03","112.76","0.02","108.23","0.02","1121","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H58 N2 O20 S2 V4 -","- C32 H58 N2 O20 S2 V4 -","- C32 H58 N2 O20 S2 V4 -","1","0.5","","MIKURIYA, Masahiro; FUKUTANI, Masami; YOSHIOKA, Daisuke","Synthesis and Crystal Structures of Dinuclear Dioxidovanadium(V) and Tetranuclear Oxidovanadium(IV) Complexes with 2,6-Bis(hydroxymethyl)-4-methylphenol","X-ray Structure Analysis Online","2015","31","0","33","","10.2116/xraystruct.31.33","","","0.71073","MoKα","","0.0658","0.0514","","","0.1398","0.1454","","","","","","0.972","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551624","10.054","0.005","8.466","0.004","12.924","0.007","90","","108.552","0.009","90","","1042.9","0.9","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N2 O3 Re S -","- C8 H11 N2 O3 Re S -","- C32 H44 N8 O12 Re4 S4 -","4","1","","MIKURIYA, Masahiro; WATANABE, Tetsuji; SUYAMA, Aiko; YOSHIOKA, Daisuke","Rhenium Complex with 2-[(2-Pyridylmethyl)amino]ethanethiol","X-ray Structure Analysis Online","2015","31","0","3","","10.2116/xraystruct.31.3","","","0.71073","MoKα","","0.0203","0.0195","","","0.0541","0.0545","","","","","","1.316","","","","has coordinates","216235","2020-10-21","18:00:00",""
"1551625","24.986","0.004","23.548","0.004","13.762","0.002","90","","101.358","0.002","90","","7939","2","200","2","200","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C75 H69 N9 O6 S3 -","- C75 H69 N9 O6 S3 -","- C300 H276 N36 O24 S12 -","4","1","","ISHIMARU, Yoshihiro; SHIMOYAMA, Naoyuki; SHIBA, Haruaki; FUJIHARA, Takashi","<i>p</i>-Nitrophenyl[36]trithianonaphyrin(1.0.0.1.0.0.1.0.0) with a Weak Antiaromatic Character","X-ray Structure Analysis Online","2015","31","0","21","","10.2116/xraystruct.31.21","","","0.71073","MoKα","","0.1709","0.0656","","","0.1368","0.1633","","","","","","0.775","","","","has coordinates","216236","2020-10-21","18:00:00",""
"1551626","10.68","0.002","13.271","0.003","19.96","0.004","86.043","0.006","84.483","0.006","87.335","0.007","2806.9","1","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H70 B2 N6 Ni O6 -","- C60 H70 B2 N6 Ni O6 -","- C120 H140 B4 N12 Ni2 O12 -","2","1","","SAKIYAMA, Hiroshi; MITSUHASHI, Ryoji; MIKURIYA, Masahiro","<i>Pseudo</i>-<i>S</i><sub>6</sub> Complex Cations of a Hexakis-<i>N</i>-methylformamide Nickel(II) Complex","X-ray Structure Analysis Online","2015","31","0","45","","10.2116/xraystruct.31.45","","","0.71073","MoKα","","0.0702","0.046","","","0.0886","0.0955","","","","","","0.973","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551627","11.4725","0.0016","12.4679","0.0017","16.113","0.002","77.391","0.002","75.265","0.002","85.548","0.002","2174.6","0.5","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H49 F6 N4 O6 Rh2 -","- C41 H49 F6 N4 O6 Rh2 -","- C82 H98 F12 N8 O12 Rh4 -","2","1","","HANDA, Makoto; TAKAHASHI, Kazuki; INOUE, Asami; IKEUE, Takahisa; YOSHIOKA, Daisuke; MIKURIYA, Masahiro","Crystal Structure of a Lantern-Type Dirhodium(II) Complex with a <i>cis</i>-(2:2) Arrangement of Two Formamidinato and Two Trifluoroacetato Bridges","X-ray Structure Analysis Online","2015","31","0","31","","10.2116/xraystruct.31.31","","","0.71073","MoKα","","0.0376","0.0275","","","0.061","0.0625","","","","","","0.92","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551628","8.496","0.0003","8.504","0.0002","17.2236","0.0006","90","","111.513","0.0015","90","","1157.71","0.06","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-Hydroxy-3-methoxybenzaldehyde 4-methylthiosemicarbazone","4-Hydroxy-3-methoxybenzaldehyde 4-methylthiosemicarbazone","","- C10 H13 N3 O2 S -","- C10 H13 N3 O2 S -","- C40 H52 N12 O8 S4 -","4","1","","de Oliveira, Adriano Bof; Beck, Johannes; Daniels, Jörg; Feitosa, Bárbara Regina Santos","Crystal Structure of 4-Hydroxy-3-methoxybenzaldehyde-4-methylthiosemicarbazone","X-ray Structure Analysis Online","2015","31","","5","","10.2116/xraystruct.31.5","","x-ray","0.71073","MoKα","","0.0682","0.0403","","","0.078","0.0876","","","","","","1.103","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551629","14.1757","0.0003","8.23382","0.00015","28.6476","0.0006","90","","102.007","0.0007","90","","3270.59","0.11","93","","93","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C16 H17 N O4 S2 -","- C16 H17 N O4 S2 -","- C128 H136 N8 O32 S16 -","8","2","","IGARASHI, Ryota; NAGASE, Hiromasa; FURUISHI, Takayuki; TOMONO, Kazuo; ENDO, Tomohiro; UEDA, Haruhisa","Crystal Structure of an Epalrestat Methanol Solvate","X-ray Structure Analysis Online","2015","31","0","1","","10.2116/xraystruct.31.1","","","1.54187","CuKα","","","0.0337","","","","0.0883","","","","","","1.088","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551630","6.425","0.0018","8.495","0.003","16.665","0.006","93.09","0.02","98.399","0.018","110.373","0.014","838.1","0.5","123","","123","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H23 N O2 -","- C20 H23 N O2 -","- C40 H46 N2 O4 -","2","1","","KUBO, Kanji; MATSUMOTO, Taisuke; IDETA, Keiko; UJIIE, Seiji","Mesomorphic Property and Crystal Structure of 4-Carboxybenzylidene-4&prime;-hexylaniline","X-ray Structure Analysis Online","2015","31","0","39","","10.2116/xraystruct.31.39","","","0.71075","MoKα","","","0.0459","","","","0.1499","","","","","","0.951","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551631","9.9553","0.0013","13.7164","0.0019","14.724","0.002","90","","102.528","0.002","90","","1962.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H31 Cl2 N3 O S3 -","- C12 H30 Cl2 N3 O S3 -","- C48 H120 Cl8 N12 O4 S12 -","4","1","","MIKURIYA, Masahiro; MIYOSHI, Kazufumi; KURANO, Shuhei; TAGUCHI, Jun; KOTERA, Takanori; YOSHIOKA, Daisuke","Synthesis and Crystal Structure of 1,4,7-Tris(2-mercaptoethyl)-1,4,7-triazacyclononane","X-ray Structure Analysis Online","2015","31","0","59","","10.2116/xraystruct.31.59","","","0.71073","MoKα","","0.0619","0.0538","","","0.1394","0.1436","","","","","","1.165","","","","has coordinates","216242","2020-10-21","18:00:00",""
"1551632","12.666","0.002","12.687","0.002","15.113","0.003","90","","90","","90","","2428.6","0.7","93","","93","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C25 H28 Cu N6 O6 -","- C25 H28 Cu N6 O6 -","- C100 H112 Cu4 N24 O24 -","4","0.5","","SAGA, Makoto; SAKANE, Genta; YAMAZAKI, Shigeo; SAITO, Keiitsu","Crystal Structure of a Copper(II) Complex with <i>N</i>,<i>N</i>&prime;-Bis(2-methylquinolyl)-dimethyl-1,3-propanediamine","X-ray Structure Analysis Online","2015","31","0","41","","10.2116/xraystruct.31.41","","","0.71075","MoKα","","0.0437","0.0356","","","0.0956","0.0994","","","","","","1.041","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551633","5.6929","0.0005","13.3409","0.0013","9.5865","0.0009","90","","106.414","0.002","90","","698.41","0.11","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4'-Bi(3-(1-methylethoxy)-3-cyclobutene-1,2-dione","","- C14 H14 O6 -","- C14 H14 O6 -","- C28 H28 O12 -","2","0.5","","UEJI, Kan; TAMAKI, Yoshinori; MIYAMURA, Kazuo","Crystal Structure of 4,4&prime;-Bi(3-(1-methylethoxy)-3-cyclobutene-1,2-dione)","X-ray Structure Analysis Online","2015","31","0","57","","10.2116/xraystruct.31.57","","","0.71073","MoKα","","0.0683","0.0423","","","0.0894","0.0991","","","","","","0.903","","","","has coordinates","216244","2020-10-21","18:00:00",""
"1551634","11.608","0.002","11.608","0.002","16.717","0.004","90","","90","","90","","2252.5","0.8","90","2","90","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C36 H54 Co4 N10 O12 -","- C36 H54 Co4 N10 O12 -","- C72 H108 Co8 N20 O24 -","2","0.25","","LIM, Jongwan; KIM, Gibeom; DO, Kyungseo; LEE, Seonghyun; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro","Tetranuclear Nickel(II) and Cobalt(II) Complexes with 3,5-Dimethyl-1-pyrazolylmethanolato and Acetato Bridges Having a Cubane Core","X-ray Structure Analysis Online","2015","31","0","49","","10.2116/xraystruct.31.49","","","0.71073","MoKα","","0.131","0.1046","","","0.2725","0.2786","","","","","","1.217","","","","has coordinates","216245","2020-10-21","18:00:00",""
"1551635","11.5812","0.0011","11.5812","0.0011","16.58","0.002","90","","90","","90","","2223.8","0.4","90","2","90","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C36 H54 N10 Ni4 O12 -","- C36 H54 N10 Ni4 O12 -","- C72 H108 N20 Ni8 O24 -","2","0.25","","LIM, Jongwan; KIM, Gibeom; DO, Kyungseo; LEE, Seonghyun; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro","Tetranuclear Nickel(II) and Cobalt(II) Complexes with 3,5-Dimethyl-1-pyrazolylmethanolato and Acetato Bridges Having a Cubane Core","X-ray Structure Analysis Online","2015","31","0","49","","10.2116/xraystruct.31.49","","","0.71073","MoKα","","0.0356","0.0288","","","0.0818","0.0842","","","","","","1.057","","","","has coordinates","216246","2020-10-21","18:00:00",""
"1551636","21.267","0.003","18.25","0.002","10.1715","0.0013","90","","99.716","0.003","90","","3891.2","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H48 Cu2 N2 O8 -","- C32 H48 Cu2 N2 O8 -","- C128 H192 Cu8 N8 O32 -","4","0.5","","MIKURIYA, Masahiro; YANO, Mari; TAKAHASHI, Naoya; YOSHIOKA, Daisuke; TANAKA, Hidekazu; HANDA, Makoto","Synthesis and Crystal Structure of a Chain Complex of Copper(II) Pivalate and 1,2-Bis(4-pyridyl)ethane in Relation to Adsorption Property for N<sub>2</sub>","X-ray Structure Analysis Online","2015","31","0","47","","10.2116/xraystruct.31.47","","","0.71073","MoKα","","0.103","0.0509","","","0.1228","0.136","","","","","","0.828","","","","has coordinates","216247","2020-10-21","18:00:00",""
"1551637","13.273","0.003","9.7015","0.0019","18.444","0.007","90","","109.5","0.03","90","","2238.8","1.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 N O3 P -","- C26 H28 N O3 P -","- C104 H112 N4 O12 P4 -","4","1","","MARANDI, Pari; RAISSI SHABARI, Akbar; KHOSRAVI, Morteza; POURAYOUBI, Mehrdad","Synthesis and Crystal Structure of a New Hydrated Phosphinate Salt, [(C<sub>6</sub>H<sub>5</sub>CH<sub>2</sub>)<sub>2</sub>NH<sub>2</sub>][(C<sub>6</sub>H<sub>5</sub>)<sub>2</sub>P(O)(O)]&middot;H<sub>2</sub>O","X-ray Structure Analysis Online","2015","31","0","37","","10.2116/xraystruct.31.37","","","0.71073","MoKα","","0.0669","0.0458","","","0.0961","0.1019","","","","","","1.04","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551638","31.61","0.02","7.686","0.005","12.807","0.008","90","","97.643","0.019","90","","3084","3","123","","123","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H50 N2 O4 -","- C34 H50 N2 O4 -","- C136 H200 N8 O16 -","4","0.5","","KUBO, Kanji; YAMAMOTO, Emi; MATSUMOTO, Taisuke; MORI, Akira","Crystal Structure of <i>N</i>,<i>N</i>&prime;-Bis(5-octyloxytropon-2-yl)piperazine","X-ray Structure Analysis Online","2015","31","0","43","","10.2116/xraystruct.31.43","","","0.71075","MoKα","","","0.0826","","","","0.2148","","","","","","1.128","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551639","10.9801","0.0015","22.581","0.003","23.805","0.003","72.198","0.002","87.088","0.002","88.497","0.003","5612","1.3","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H70 B2 Co N6 O6 -","- C60 H70 B2 Co N6 O6 -","- C240 H280 B8 Co4 N24 O24 -","4","2","","YAMAGUCHI, Ryo; YOSHIOKA, Daisuke; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi","Structural Feature of an Hexakis-<i>N</i>-methylformamide Cobalt(II) Complex: <i>Pseudo</i>-<i>S</i><sub>6</sub> and <i>Pseudo</i>-<i>C</i><sub>2</sub> Complex Cations","X-ray Structure Analysis Online","2015","31","0","7","","10.2116/xraystruct.31.7","","","0.71073","MoKα","","0.0769","0.0381","","","0.0709","0.0839","","","","","","0.808","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551640","8.9849","0.0011","12.53","0.0015","17.441","0.002","90","","90","","90","","1963.5","0.4","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3<i>β</i>-Propanoyloxyandrost-5-en-17-one","","- C22 H32 O3 -","- C22 H32 O3 -","- C88 H128 O12 -","4","1","","Ortiz, Aylin Viviana Silva; Cabeza, Marisa; Bratoeff, Eugene; Soriano-García, Manuel","Crystal Structure and Synthesis of Two Steroidal Derivatives: 3<i>β</i>-Propanoyloxyandrost-5-en-17-one and 3<i>β</i>-Pentanoyloxyandrost-5-en-17-one","X-ray Structure Analysis Online","2015","31","0","9","","10.2116/xraystruct.31.9","","","0.71073","MoKα","","0.1193","0.0607","","","0.1282","0.152","","","","","","1.02","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551641","12.2123","0.0015","12.5684","0.0016","12.9841","0.0016","100.526","0.002","107.424","0.0019","116.156","0.0019","1587.4","0.3","100","","100","","","","","","","","","6","P 1","P 1","1","","Bis(acetone-κO)-1,4,8,11-tetraazacyclotetradecane Copper(II) Ditetraphenylborate Acetone Disolvate","","- C70 H88 B2 Cu N4 O4 -","- C70 H88 B2 Cu N4 O4 -","- C70 H88 B2 Cu N4 O4 -","1","1","","MATSUI, Chihiro; OKAWARA, Toru; NAGAMURA, Toshihiko; TAKEHARA, Kenji","Crystal Structure of Bis(acetone-<i>&kappa;</i><i>O</i>)-1,4,8,11-tetraazacyclotetradecane Copper(II) Ditetraphenylborate Acetone Disolvate","X-ray Structure Analysis Online","2015","31","0","53","","10.2116/xraystruct.31.53","","","0.71073","MoKα","","0.0471","0.0392","","","0.0941","0.0999","","","","","","1.039","","","","has coordinates,has disorder","301780","2025-08-18","21:43:24",""
"1551642","6.4713","0.0003","6.7196","0.0003","17.9369","0.0007","90","","90","","90","","779.98","0.06","123","2","123","2","","","101.3","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H11 N O3 -","- C7 H11 N O3 -","- C28 H44 N4 O12 -","4","1","","INADA, Aya; KANAZAWA, Hitoshi; UEKUSA, Hidehiro","Crystal Structure of <font size=-1>L</font>-Isoleucine <i>N</i>-Carboxy Anhydride","X-ray Structure Analysis Online","2015","31","0","17","","10.2116/xraystruct.31.17","","","1.54186","CuKα","","0.056","0.0484","","","0.1207","0.1332","","","","","","1.091","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551643","12.4671","0.0016","10.1719","0.0013","29.292","0.004","90","","101.26","0.003","90","","3643.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 Cl4 Co2 N10 -","- C30 H40 Cl4 Co2 N10 -","- C120 H160 Cl16 Co8 N40 -","4","1","","LIM, Jongwan; SON, Young; GU, Gimoon; RYU, Sanghoon; YOSHIOKA, Daisuke; MIKURIYA, Masahiro","Dinuclear Cobalt(II) Complex with <i>N</i>,<i>N</i>,<i>N</i>&prime;,<i>N</i>&prime;-Tetrakis(3,5-dimethyl-1-pyrazolyl)methyl-1,4-phenylenediamine Having a Tetrahedral Coordination Geometry","X-ray Structure Analysis Online","2015","31","0","25","","10.2116/xraystruct.31.25","","","0.71073","MoKα","","0.1217","0.0589","","","0.1034","0.1203","","","","","","0.923","","","","has coordinates","216254","2020-10-21","18:00:00",""
"1551644","24.679","0.004","9.873","0.004","9.253","0.005","90","","90","","90","","2254.5","1.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C10 H13 Cl F N O2 -","- C10 H13 Cl F N O2 -","- C80 H104 Cl8 F8 N8 O16 -","8","1","","Guillon, Jean; Pinaud, Noël; Marchivie, Mathieu; Ronga, Luisa; Benazzouz, Abdelhamid; Moreau, Stéphane","Crystal Structure of a Fluoro Analogue of 3,4-(Methylenedioxy)amphetamine","X-ray Structure Analysis Online","2015","31","","23","","10.2116/xraystruct.31.23","","","1.5418","CuKα","","0.0993","0.0601","","","0.1479","0.173","","","","","","1.062","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551645","9.837","0.004","13.221","0.003","16.325","0.006","90","","107.914","0.015","90","","2020.2","1.2","93","","93","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H19 N O2 -","- C27 H19 N O2 -","- C108 H76 N4 O8 -","4","1","","AKITA, Motoko; KIMURA, Yuko; KOBAYASHI, Keiji","Crystal Structure of 2-(<i>p</i>-Anilinophenyl)-2-phenylindan-1,3-dione and Its Unexpected Formation","X-ray Structure Analysis Online","2015","31","0","13","","10.2116/xraystruct.31.13","","","0.71075","MoKα","","","0.0388","","","","0.1011","","","","","","1.037","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551646","8.7451","0.0009","15.1964","0.0013","6.9425","0.0006","90","","113.561","0.002","90","","845.7","0.14","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O2 -","- C22 H20 N2 O2 -","- C44 H40 N4 O4 -","2","0.5","","AKITA, Motoko; KASONO, Masaki; KOBAYASHI, Keiji","Crystal Structure of 3,3&prime;-Ethanediylidenebis(1-ethylindoline-2-one): An Unexpected Byproduct in <i>N</i>-Ethylation of Isatin in Tetrahydrofurane","X-ray Structure Analysis Online","2015","31","0","11","","10.2116/xraystruct.31.11","","","0.71075","MoKα","","","0.0434","","","","0.1188","","","","","","1.046","","","","has coordinates","301780","2025-08-18","21:43:24",""
"1551647","9.4884","0.0006","9.5235","0.0006","18.154","0.0013","90","","95.203","0.0018","90","","1633.69","0.19","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 Br O4 S -","- C17 H17 Br O4 S -","- C68 H68 Br4 O16 S4 -","4","1","","KUBO, Kanji; MATSUMOTO, Taisuke","Crystal Structure of 7-Bromo-4-isopropyl-2-[[(4-methylphenyl)sulfonyl]oxy]-tropone","X-ray Structure Analysis Online","2015","31","0","29","","10.2116/xraystruct.31.29","","","0.71075","MoKα","","","0.0486","","","","0.1211","","","","","","1.392","","","","has coordinates","301780","2025-08-18","21:43:24",""
"2000068","25.475","0.005","10.767","0.002","19.046","0.004","90","","112.54","0.02","90","","4825.06","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H68 N6 O32 V10 -","- C18 H68 N6 O60 V20 -","- C72 H272 N24 O240 V80 -","4","0.5","","Averbuch-Pouchot, M. T.; Durif, A.","Preparation and crystal-structure of hexas (isopropylammonium) decavanadate tetrahydrate","European Journal of Solid State and Inorganic Chemistry","1994","31","5","351","361","","","","","","","","0.029","","","0.029","","","","","","","","","","","has coordinates","182180","2020-10-21","18:00:00",""
"2000135","9.777","0.002","10.64","0.002","15.384","0.003","90","","90","","90","","1600.36","","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","catena-(dabconium tris(phosphato)-zinc)","","","- C6 H19 N2 O12 P3 Zn -","- C6 H19 N2 O12 P3 Zn -","- C24 H76 N8 O48 P12 Zn4 -","4","1","","Patarin, J.; Marler, B.; Huve, L.","Synthesis and structure of Zn(H2PO4)(2)(HPO4).H2N2C6H12","European Journal of Solid State and Inorganic Chemistry","1994","31","10","909","920","","","","","","","","0.06","","","0.06","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002173","5.462","","5.462","","12.591","","90","","90","","90","","375.6","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Distrontium tricopper tetraoxide dichloride","","- Cl2 Cu3 O4 Sr2 -","- Cl2 Cu3 O4 Sr2 -","- Cl4 Cu6 O8 Sr4 -","2","0.0625","","Grande, B; Mueller-Buschbaum, Hk","Ueber Oxocuprate, XIX. Zur Kristallchemie von Sr2 Cu3 O4 Cl2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","405","407","","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002210","10.639","","9.094","","2.96","","90","","90","","90","","286.4","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Calcium dichromium oxide - $-beta","","- Ca Cr2 O4 -","- Ca Cr2 O4 -","- Ca4 Cr8 O16 -","4","0.5","","Hörkner, W.; Müller-Buschbaum, Hk.","Einkristalluntersuchungen von β-CaCr~2~O~4~","Zeitschrift für Naturforschung, Teil B: Anorganische Chemie, Organische Chemie","1976","31","12","1710","1711","10.1515/znb-1976-1229","","","","","","0.072","","","","","","","","","","","","","","","has coordinates","200084","2020-10-21","18:00:00",""
"2002211","10.424","","8.718","","7.986","","90","","94.77","","90","","723.2","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Calcium gallium aluminium oxide","","- Al Ca Ga O4 -","- Al Ca Ga O4 -","- Al8 Ca8 Ga8 O32 -","8","2","","Mueller-Buschbaum, Hk; Schmachtel, W","Ueber Erdalkalimetalloxogallate. VI. Zum Problem der Mischkristallbildung zwischen Ca Ga2 O4 und Ca Al2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1604","1606","","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002212","8.757","","8.113","","15.334","","90","","90.27","","90","","1089.4","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Calcium gallium aluminium oxide (1/.5/1.5/4)","","- Al1.5 Ca Ga0.5 O4 -","- Al1.5 Ca Ga0.5 O4 -","- Al18 Ca12 Ga6 O48 -","12","3","","Mueller-Buschbaum, Hk; Schmachtel, W","Ueber Erdalkalimetalloxogallate. VI. Zum Problem der Mischkristallbildung zwischen Ca Ga2 O4 Und Ca Al2 O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1604","1606","","","","","","","0.091","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002219","8.623","","8.623","","5.909","","90","","90","","90","","439.4","","","","","","","","","","","","","3","I 4 c m","I 4 -2c","108","","Dibismuth palladate","","- Bi2 O4 Pd -","- Bi2 O4 Pd -","- Bi8 O16 Pd4 -","4","0.25","","Arpe, R; Mueller-Buschbaum, Hk","Zur Kenntnis von Bi2 Pd O4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1708","1709","","","","","","","0.127","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002220","5.714","","5.714","","22.784","","90","","90","","120","","644.2","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Strontium heptairon(III) pentaaluminium oxide","","- Al5 Fe7 O19 Sr -","- Al4.9998 Fe7.0002 O19 Sr -","- Al9.9996 Fe14.0004 O38 Sr2 -","2","0.0833333","","Pausch, H; Mueller-Buschbaum, Hk","Zur Metallverteilung in Sr Fe7 Al5 O19","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1148","1148","","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002221","11.257","","11.257","","5.853","","90","","90","","120","","642.3","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","Nonabarium dichloro-15-oxoheptacuprate","","- Ba9 Cl2 Cu7 O15 -","- Ba9 Cl2 Cu7 O15 -","- Ba9 Cl2 Cu7 O15 -","1","0.0416667","","Kipka, R; Mueller-Buschbaum, Hk","Ueber Oxocuprate, XVI. Ba9 Cu7 O15 Cl2 mit Cu2+ in neuer Koordination","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1067","1069","","","","","","","0.1","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:21",""
"2002222","17.452","","17.452","","3.33","","90","","90","","120","","878.3","","","","","","","","","","","","","4","P 63","P 6c","173","","Strontium dicalcium decaytterbium oxide","","- Ca2 O18 Sr Yb10 -","- Ca2.0001 O18 Sr Yb9.9999 -","- Ca4.0002 O36 Sr2 Yb19.9998 -","2","0.333333","","Muschick, M; Mueller-Buschbaum, Hk","Zur Verbindungsbildung von Me O : Me2 O3, II. Ueber Sr Ca2 Yb10 O18 und Sr Ca2 Lu10 O18","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1064","1066","","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002223","17.40399","","17.40399","","3.307","","90","","90","","120","","867.5","","","","","","","","","","","","","4","P 63","P 6c","173","","Strontium dicalcium decalutetium oxide","","- Ca2 Lu10 O18 Sr -","- Ca2.0001 Lu9.9999 O18 Sr -","- Ca4.0002 Lu19.9998 O36 Sr2 -","2","0.333333","","Muschick, M; Mueller-Buschbaum, Hk","Zur Verbindungsbildung von Me O : Me2 O3, II. Ueber Sr Ca2 Yb10 O18 und Sr Ca2 Lu10 O18","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1064","1066","","","","","","","0.098","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002287","5.489","","5.489","","13.306","","90","","90","","90","","400.9","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Distrontium tricopper oxide dibromide","","- Br2 Cu3 O4 Sr2 -","- Br2 Cu3 O4 Sr2 -","- Br4 Cu6 O8 Sr4 -","2","0.0625","","Grande, B; Mueller-Buschbaum, Hk","Ueber Oxocuprate, XVIII. Zur Kristallstruktur von Sr2 Cu3 O4 Br2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1183","1184","","","","","","","0.07","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2105342","4.5979","","4.5979","","15.029","","90","","90","","120","","275.156","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.333333","","Schock, R.N.; Johnson, Q.","The 4h polytype of silver iodide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1482","1483","10.1107/S056774087500547X","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2105343","10.01","","4.78","","19.32","","90","","90","","90","","924.419","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","K2 (Ag I3)","","- Ag I3 K2 -","- Ag I3 K2 -","- Ag4 I12 K8 -","4","0.5","","Thackeray, M.M.; Coetzer, J.","Dipotassium silver triiodide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2339","2340","10.1107/S0567740875007510","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105369","8.173","","8.173","","8.173","","90","","90","","90","","545.939","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Ag4 Te (N O3)2","","- Ag4 N2 O6 Te -","- Ag4 N2 O6 Te -","- Ag16 N8 O24 Te4 -","4","0.166667","","Schultze-Rhonhof, E.","Die Kristallstruktur von alpha-Tetrasilbertelluriddinitrat","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2837","2840","10.1107/S0567740875009004","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105406","9.2792","","8.9103","","13.3719","","90","","90","","90","","1105.59","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Ca (B F4)2","","- B2 Ca F8 -","- B2 Ca F8 -","- B16 Ca8 F64 -","8","1","","Brown, W.E.; Schroeder, L.W.; Jordan, T.H.; Dickens, B.","The crystal structure of Ca (B F4)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","669","672","10.1107/S0567740875003597","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105421","9.734","","9.734","","7.279","","90","","90","","120","","597.29","","","","","","","","","","","","","5","P -3","-P 3","147","","Sr9.402 Na0.209 B0.996 O2 (P O4)6","","- B0.996 Na0.209 O26 P6 Sr9.402 -","- B Na0.208 O26 P6 Sr9.402 -","- B Na0.208 O26 P6 Sr9.402 -","1","0.166667","","Calvo, C.; Faggiani, R.; Krishnamachari, N.","The crystal structure of sodium strontium boron dioxide hexaphosphate - a deviant apatite","Acta Crystallographica B (24,1968-38,1982)","1975","31","","188","192","10.1107/S0567740875002336","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105426","8.83","","8.83","","5.072","","90","","90","","90","","395.458","","","","","","","","","","","","","2","P 42/n n m :1","P 4n 2 -1n","134","","(B12)4 B2 Ti1.87","","- B50 Ti1.87 -","- B50 Ti1.872 -","- B50 Ti1.872 -","1","0.0625","","Amberger, E.; Polbov, K.","Struktur des tetragonalen (B12)4 B2 Ti1.3...2.0","Acta Crystallographica B (24,1968-38,1982)","1975","31","","949","953","10.1107/S0567740875004268","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2106114","6.4492","","6.5187","","9.944","","84.709","","99.588","","119.979","","357.04","","","","","","","","","","","","","3","P -1","-P 1","2","","Mn7.53 Si1.8 C1.33","","- C1.33 Mn7.53 Si1.8 -","- C1.33333 Mn7.53333 Si1.8 -","- C4 Mn22.6 Si5.4 -","3","1.5","","Spinat, P.; Brouty, C.; Whuler, A.; Herpin, P.","Etude structurale de la phase Mn8 Si2 C","Acta Crystallographica B (24,1968-38,1982)","1975","31","","541","547","","","","","","","","","","","","","","","","","","","","","","has coordinates","143238","2020-10-21","18:00:00",""
"2106268","8.481","","13.142","","14.444","","90","","115.48","","90","","1453.3","","","","","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","Sr Ga2 Si2 O8","","- Ga2 O8 Si2 Sr -","- Ga2 O8 Si2 Sr -","- Ga16 O64 Si16 Sr8 -","8","1","","Calleri, M.; Gazzoni, G.","Structures of (Sr, Ba) ((Al, Ga)2 (Si, Ge)2 O8). I. The crystal structures of the synthetic feldspars Sr Ga2 Si2 O8 and Ba Ga2 Si2 O8","Acta Crystallographica B (24,1968-38,1982)","1975","31","","560","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106269","8.727","","13.24","","14.608","","90","","115","","90","","1529.75","","","","","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","Ba Ga2 Si2 O8","","- Ba Ga2 O8 Si2 -","- Ba Ga2 O8 Si2 -","- Ba8 Ga16 O64 Si16 -","8","1","","Calleri, M.; Gazzoni, G.","Structures of (Sr,Ba)((Al,Ga)2 (Si,Ge)2 O8). I. The crystal structures of the synthetic feldspars Sr Ga2 Si2 O8 and Ba Ga2 Si2 O8","Acta Crystallographica B (24,1968-38,1982)","1975","31","","560","568","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106328","4.69","","4.69","","16.39","","90","","90","","90","","360.516","","","","","","","","","","","","","2","I 4 m m","I 4 -2","107","","","","- Ca2 Sb -","- Ca2 Sb -","- Ca8 Sb4 -","4","0.25","","Hamon, C.; Marchand, R.; Laurent, Y.; l'Haridon, P.","Etude structurale de Ca2 Sb","Acta Crystallographica B (24,1968-38,1982)","1975","31","","427","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106343","18.28999","","17.67","","5.28","","90","","90","","90","","1706.41","","","","","","","","","","","","","8","P n m a","-P 2ac 2n","62","","Na0.08 Li7.28 Mg6.96 Fe6 (Al8.02 Si31.42 O88) (O H)8","","- Al8.02 Fe6 H8 Li7.28 Mg6.96 Na0.08 O96 Si31.42 -","- Al8.016 Fe6 Li7.28 Mg6.96 Na0.08 O96 Si31.424 -","- Al8.016 Fe6 Li7.28 Mg6.96 Na0.08 O96 Si31.424 -","1","0.125","","Irusteta, M.C.; Whittaker, E.J.W.","A three-dimensional refinement of the structure of holmquistite","Acta Crystallographica B (24,1968-38,1982)","1975","31","","145","150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106366","6.772","","12.726","","13.392","","90","","120.1","","90","","998.496","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Sb5 O7 I","","- I O7 Sb5 -","- I O7 Sb5 -","- I4 O28 Sb20 -","4","1","","Kraemer, V.","The crystal structure of ferroelastic antimony(III) oxide iodide alpha Sb5 O7 I","Acta Crystallographica B (24,1968-38,1982)","1975","31","","234","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106386","6.48","","6.51","","9.7","","71.82","","99.89","","113.13","","356.948","","","","","","","","","","","","","3","P -1","-P 1","2","","K4 (Sn O4)","","- K4 O4 Sn -","- K4 O4 Sn -","- K8 O8 Sn2 -","2","1","","Marchand, R.; Piffard, Y.; Tournoux, M.","Structure cristalline de l'orthostannate de potassium K4 Sn O4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","511","514","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106394","6.334","","4.948","","8.033","","90","","107.9","","90","","239.573","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ca (C O3)","","- C Ca O3 -","- C Ca O3 -","- C4 Ca4 O12 -","4","1","","Merrill, L.; Bassett, W.A.","Crystal structure of Ca C O3(II), a high-pressure metastable phase calcium carbonate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","343","349","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106398","9.661","","6.544","","8.253","","90","","92.37","","90","","521.321","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Pb (N C S)2","","- C2 N2 Pb S2 -","- C2 N2 Pb S2 -","- C8 N8 Pb4 S8 -","4","0.5","","Mokuolu, J.A.A.; Speakman, J.C.","The crystal structure of lead(II) thiocyanate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","172","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106434","5.6261","","11.889","","6.473","","98.633","","118.2","","83.344","","376.752","","","","","","","","","","","","","4","P -1","-P 1","2","","Ca (H2 P O4)2 (H2 O)","","- Ca H6 O9 P2 -","- Ca H6 O9 P2 -","- Ca2 H12 O18 P4 -","2","1","","Schroeder, L.W.; Prince, E.; Dickens, B.","Hydrogen bonding in Ca (H2 P O4)2 (H2 O) as determined by neutron diffraction","Acta Crystallographica B (24,1968-38,1982)","1975","31","","9","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106463","14.04","","14.04","","15.05","","90","","90","","120","","2569.22","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","","","- Ga40.392 Mo7.396 -","- Ga40.392 Mo7.396 -","- Ga121.176 Mo22.188 -","3","0.166667","","Yvon, K.","Mo8 Ga41 another example of ten-coordination of the transition element","Acta Crystallographica B (24,1968-38,1982)","1975","31","","117","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106477","9.562","","13.087","","10.387","","115.75","","80.9","","112.66","","1080.3","","","","","","","","","","","","","5","P -1","-P 1","2","","K4 Th (C2 O4)4 (H2 O)4","","- C8 H8 K4 O20 Th -","- C8 K4 O20 Th -","- C16 K8 O40 Th2 -","2","1","","Akhtar, M.N.; Smith, A.J.","The crystal structure of tetrapotassium tetraoxalatothorium(IV) tetrahydrate, K4 Th (C2 O4)4 (H2 O)4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1361","1366","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106484","13.43","","8.34","","17.07","","90","","122.8","","90","","1607.12","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Cu (S C (N H N H2)2)2 (S O4)) (H2 O)4","","- C2 H20 Cu N8 O8 S3 -","- C2 H20 Cu N8 O8 S3 -","- C8 H80 Cu4 N32 O32 S12 -","4","1","","Bigoli, F.; Pellinghelli, M.A.; Tiripicchio Camellini, M.; Tiripicchio, A.","The crystal and molecular structure of sulfatobis(thiocarbonohydrazide- N,S) copper(II) tetrahydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","55","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106485","6.751","","6.699","","6.451","","94.53","","96.3","","101.28","","282.869","","","","","","","","","","","","","4","P -1","-P 1","2","","Ni S2 O6 (H2 O)6","","- H6 Ni O12 S2 -","- H12 Ni O12 S2 -","- H12 Ni O12 S2 -","1","0.5","","Black, W.H.; Griffith, E.A.H.; Robertson, B.E.","M S2 O6 (H2 O)6 (M = Mg, Ni, Zn)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","615","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","206183","2020-10-21","18:00:00",""
"2106486","6.799","","6.752","","6.491","","94.58","","96.2","","101.47","","288.748","","","","","","","","","","","","","4","P -1","-P 1","2","","Zn S2 O6 (H2 O)6","","- H12 O12 S2 Zn -","- H12 O12 S2 Zn -","- H12 O12 S2 Zn -","1","0.5","","Black, W.H.; Griffith, E.A.H.; Robertson, B.E.","M S2 O6 (H2 O)6 (M = Mg, Ni, Zn)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","615","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106488","7.33","","7.33","","7.864","","90","","90","","120","","365.917","","","","","","","","","","","","","2","P 63","P 6c","173","","","","- Cu20 Sn6 -","- Cu20 Sn6 -","- Cu20 Sn6 -","1","0.166667","","Brandon, J.K.; Pearson, W.B.; Tozer, D.J.N.","A single-crystal X-ray diffraction of the zeta bronze structure, Cu20 Sn6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","774","779","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106490","16.911","","3.871","","9.334","","90","","113.67","","90","","559.623","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Pa O Br3","","- Br3 O Pa -","- Br3 O Pa -","- Br12 O4 Pa4 -","4","0.5","","Brown, D.; Petcher, T.J.; Smith, A.J.","The Crystal Structure of Protactinium oxytribromide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1382","1385","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106491","12.381","","12.791","","11.801","","90","","90","","90","","1868.87","","","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","Ca K (Co (S2 C2 O2)3) (H2 O)4","","- C6 H8 Ca Co K O10 S6 -","- C6 H8 Ca Co K O10 S6 -","- C24 H32 Ca4 Co4 K4 O40 S24 -","4","1","","Butler, K. R.; Snow, M. R.","The crystal structure of calcium potassium(+)589-tris(dithiooxalato)cob altate(III) tetrahydrate: an application of anomalous dispersion patterson methods","Acta Crystallographica B (24,1968-38,1982)","1975","31","2","354","358","10.1107/S0567740875002798","","","","","","","","","","","","","","","","","","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2106493","11.318","","3.611","","4.797","","90","","90","","90","","196.05","","","","","","","","","","","","","3","P 21 m n","P -2ab 2ab","31","","Na V2 O5","","- Na O5 V2 -","- Na O5 V2 -","- Na2 O10 V4 -","2","0.5","","Carpy, A.; Galy, J.","Affinement de la structure cristalline du bronze Na V2 O5 alpha'","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1481","1482","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106497","5.4647","","8.6439","","6.2308","","90","","90","","90","","294.32","","","","","","","","","","","","","3","P 21 c n","P -2n 2a","33","","(H3 O) (N O3)","","- H3 N O4 -","- H3 N O4 -","- H12 N4 O16 -","4","1","","Delaplane, R.G.; Taesler, I.; Olovsson, I.","Hydrogen bond studies. XCIII. Oxonium ion in nitric acid monohydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1486","1489","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106500","11.116","","12.981","","5.354","","90","","90","","90","","772.565","","","","","","","","","","","","","7","P 21 21 2","P 2 2ab","18","","K2 (Co (N C S)4) (H2 O)3","","- C4 H6 Co K2 N4 O3 S4 -","- C4 H6 Co K2 N4 O3 S4 -","- C8 H12 Co2 K4 N8 O6 S8 -","2","0.5","","Drew, M.G.B.; Othman, A.H.","Potassium tetrakis(isothiocyanato)cobaltate(II) trihydrate; a redetermination","Acta Crystallographica B (24,1968-38,1982)","1975","31","","613","614","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106505","11.18","","11.18","","8.235","","90","","90","","120","","891.411","","","","","","","","","","","","","2","P 6/m","-P 6","175","","","","- Cu51 Hf14 -","- Cu51 Hf14 -","- Cu51 Hf14 -","1","0.0833333","","Gabathuler, J.P.; Parthe, E.; White, P.","Zr14 Cu51 and Hf14 Cu51 with Gd Ag3.6 structure type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","608","610","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106508","21.44","","5.559","","14.338","","90","","122.74","","90","","1437.39","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cs2 (Mo5 O16)","","- Cs2 Mo5 O16 -","- Cs2 Mo5 O16 -","- Cs8 Mo20 O64 -","4","0.5","","Gatehouse, B.M.; Miskin, B.K.","The crystal structures of cesium pentamolybdate, Cs2 Mo5 O16, and cesium heptamolybdate, Cs2 Mo7 O22","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1293","1299","","","","","","","","","","","","","","","","","","","","","","has coordinates","150878","2020-10-21","18:00:00",""
"2106509","21.54","","5.537","","18.91","","90","","122.71","","90","","1897.68","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cs2 (Mo7 O22)","","- Cs2 Mo7 O22 -","- Cs2 Mo7 O22 -","- Cs8 Mo28 O88 -","4","0.5","","Gatehouse, B.M.; Miskin, B.K.","The crystal structures of cesium pentamolybdate, Cs2 Mo5 O16, and cesium heptamolybdate, Cs2 Mo7 O22","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1293","1299","","","","","","","","","","","","","","","","","","","","","","has coordinates","150879","2020-10-21","18:00:00",""
"2106510","5.6727","","15.582","","5.5303","","90","","90","","90","","488.834","","","","","","","","","","","","","3","I c m m","-I 2 2b","74","","Sr2 (Fe2 O5)","","- Fe2 O5 Sr2 -","- Fe2 O5 Sr2 -","- Fe8 O20 Sr8 -","4","0.25","","Greaves, C.; Jacobson, A.J.; Tofield, B.C.; Fender, B.E.F.","A powder neutron diffraction investigation of the nuclear and magnetic structure of Sr2 Fe2 O5","Acta Crystallographica B (24,1968-38,1982)","1975","31","","641","646","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2106511","7.776","","7.776","","49.86","","90","","90","","90","","3014.84","","","","","","","","","","","","","3","P 4/n c c :2","-P 4a 2ac","130","","","","- Ba5 Fe9 S18 -","- Ba5 Fe9 S18 -","- Ba20 Fe36 S72 -","4","0.25","","Grey, I.E.","The structure of Ba5 Fe9 S18","Acta Crystallographica B (24,1968-38,1982)","1975","31","","45","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106513","11.661","","6.404","","6.694","","90","","105.37","","90","","482.009","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Eu Cl2 (H2 O)2","","- Cl2 Eu H4 O2 -","- Cl2 Eu O2 -","- Cl8 Eu4 O8 -","4","0.5","","Haase, A.; Brauer, G.","Europium dichloride dihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","290","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106514","7.134","","17.651","","7.267","","90","","111.74","","90","","849.991","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Si9.04 Ca11.44 As16","","- As16 Ca11.44 Si9.04 -","- As16 Ca11.44 Si9.04 -","- As16 Ca11.44 Si9.04 -","1","0.25","","Hamon, M.; l'Haridon, P.; Guyader, J.; Laurent, Y.","Etude d'arseniures et phosphures doubles. Structure de Ca10+x Si12-2x As16 (et P16)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","445","449","","","","","","","","","","","","","","","","","","","","","","has coordinates","150946","2020-10-21","18:00:00",""
"2106515","9.4818","","5.4842","","18.182","","90","","101.738","","90","","925.694","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Fe1.81 Mg0.27 Al3.92 Si2 O10 (O H)4","","- Al3.92 Fe1.81 H4 Mg0.27 O14 Si2 -","- Al3.92 Fe1.81 Mg0.27 O14 Si2 -","- Al15.68 Fe7.24 Mg1.08 O56 Si8 -","4","0.5","","Hanscom, R.H.","Refinement of the crystal structure of monoclinic choritoid","Acta Crystallographica B (24,1968-38,1982)","1975","31","","780","784","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106516","9.691","","6.091","","17.111","","90","","126.4","","90","","812.964","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Na2 Cu (C O3)2 (H2 O)3","","- C2 H6 Cu Na2 O9 -","- C2 H6 Cu Na2 O9 -","- C8 H24 Cu4 Na8 O36 -","4","1","","Harlow, R.L.; Simonsen, S.H.","An independant investigation of the crystal structure of Na2 Cu (C O3)2 (H2 O)3 with diffractiometer data","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1313","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106518","5.45","","5.45","","8.101","","90","","90","","120","","208.383","","","","","","","","","","","","","4","P -3 1 m","-P 3 2","162","","Ba Sr (Fe4 O8)","","- Ba Fe4 O8 Sr -","- Ba Fe4 O8 Sr -","- Ba Fe4 O8 Sr -","1","0.0833333","","Herman-Ronzaud, D.; Bachmann, M.","La structure cristalline de Ba Sr Fe4 O8","Acta Crystallographica B (24,1968-38,1982)","1975","31","","665","668","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106519","20.105","","3.892","","15.432","","90","","90","","90","","1207.53","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Bi6 O7 F Cl3","","- Bi6 Cl3 F O7 -","- Bi6 Cl3 F O7 -","- Bi24 Cl12 F4 O28 -","4","0.5","","Hopfgarten, F.","The Crystal Structure of Bi6 O7 F Cl3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1087","1092","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106520","11.221","","17.529","","9.729","","90","","90","","90","","1913.62","","","","","","","","","","","","","5","C c m 21","C 2c -2c","36","","Co2 (N H3)8 (N H2) (N O2) Cl4 (H2 O)2","","- Cl4 Co2 H30 N10 O4 -","- Cl4 Co2 H28 N10 O4 -","- Cl16 Co8 H112 N40 O16 -","4","0.5","","Huang, C.Y.; Weil, J.A.; Robertson, B.E.","Mue-amido-mue-nitrito-bis(tetraamminecobalt(III)) tetrachloride dihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","914","916","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106522","3.933","","26.726","","5.683","","90","","90","","90","","597.359","","","","","","","","","","","","","3","C m c 21","C 2c -2","36","","Sr2 (Nb2 O7)","","- Nb2 O7 Sr2 -","- Nb2 O7 Sr2 -","- Nb8 O28 Sr8 -","4","0.5","","Ishizawa, N.; Marumo, F.; Kawamura, T.; Kimura, M.","The crystal structure of Sr2 Nb2 O78, a compound with perovskite-type slabs","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1912","1915","","","","","","","","","","","","","","","","","","","","","","has coordinates","151049","2020-10-21","18:00:00",""
"2106525","6.2173","","6.2173","","12.271","","90","","90","","120","","410.785","","","","","","","","","","","","","3","P 63 2 2","P 6c 2c","182","","Ca (Ta4 O11)","","- Ca O11 Ta4 -","- Ca O11 Ta4 -","- Ca2 O22 Ta8 -","2","0.166667","","Isobe, M.; Marumo, F.; Iwai, S.I.; Kimura, M.","Calcium tetratantalate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","908","910","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106526","10.513","","5.0944","","21.804","","90","","94.71","","90","","1163.82","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Mn P4 -","- Mn P4 -","- Mn16 P64 -","16","2","","Jeitschko, W.; Donohue, P.C.","High-pressure Mn P4 , a polyphosphide with Mn-Mn pairs","Acta Crystallographica B (24,1968-38,1982)","1975","31","","574","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106527","11.4585","","7.7215","","7.2207","","90","","90","","90","","638.864","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Y2 Hf S5","","- Hf S5 Y2 -","- Hf S5 Y2 -","- Hf4 S20 Y8 -","4","0.5","","Jeitschko, W.; Donohue, P.C.","Y2 Hf S5 with ordered U3 Se5 type structure and related compounds","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1890","1895","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106528","5.947","","3.826","","7.051","","90","","90","","90","","160.433","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Mn.997 Co0.974 Ge","","- Co0.974 Ge Mn0.997 -","- Co0.974 Ge Mn0.997 -","- Co3.896 Ge4 Mn3.988 -","4","0.5","","Jeitschko, W.","A high-temperature X-ray study of the displacive phase transition in Mn Co Ge","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1187","1190","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106529","5.316","","4.087","","7.079","","90","","90","","90","","153.802","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Mn0.997 Co0.974 Ge","","- Co0.974 Ge Mn0.997 -","- Co0.974 Ge Mn0.997 -","- Co3.896 Ge4 Mn3.988 -","4","0.5","","Jeitschko, W.","A high-temperature X-ray study of the displacive phase transition in Mn Co Ge","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1187","1190","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106534","6.175","","29.175","","3.93","","90","","90","","90","","708.012","","","","","","","","","","","","","2","P b a m","-P 2 2ab","55","","","","- Nb16.8 O42 -","- Nb16.8 O42 -","- Nb16.8 O42 -","1","0.125","","Kato, K.; Tamura, S.","Die Kristallstruktur von T-Nb2 O5","Acta Crystallographica B (24,1968-38,1982)","1975","31","","673","677","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106537","6.033","","6.033","","8.69","","90","","90","","90","","316.291","","","","","","","","","","","","","2","I 4/m c m","-I 4 2c","140","","U3 Si","","- Si U3 -","- Si U3 -","- Si4 U12 -","4","0.125","","Kimmel, G.","Atomic positions in U3 Si","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1351","1353","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106538","4.045","","4.045","","9.9","","90","","90","","120","","140.282","","","","","","","","","","","","","3","P -3","-P 3","147","","Bi2 U O6","","- Bi2 O6 U -","- Bi2 O6 U -","- Bi2 O6 U -","1","0.166667","","Koster, A.S.; Renaud, J.P.P.; Rieck, G.D.","The crystal structures at 295 and 1275 K of bismuth uranate, Bi2 U O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","127","131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106539","6.872","","4.009","","9.69","","90","","90.16","","90","","266.957","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","Bi2 U O6","","- Bi2 O6 U -","- Bi2 O6 U -","- Bi4 O12 U2 -","2","0.5","","Koster, A.S.; Renaud, J.P.P.; Rieck, G.D.","The crystal structures at 295 and 1275 K of bismuth uranate, Bi2 U O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","127","131","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106542","21.382","","7.286","","9.52","","90","","97.96","","90","","1468.82","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Ba2 Cu (P O3)6","","- Ba2 Cu O18 P6 -","- Ba2 Cu O18 P6 -","- Ba8 Cu4 O72 P24 -","4","1","","Laugt, M.; Guitel, J.C.","Structure cristalline du polyphosphate de baryum-cuivre Ba2 Cu (P O3)6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1148","1153","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106548","17.66","","7.148","","6.817","","90","","112.8","","90","","793.296","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Cu (H2 O)4 (U O2)2 (H Ge O4)2 (H2 O)2","","- Cu Ge2 H14 O18 U2 -","- Cu Ge2 O18 U2 -","- Cu2 Ge4 O36 U4 -","2","0.25","","Legros, J.P.; Jeannin, Y.P.","Coordination de l'uranium par l'ion germanate. I. Structure d'un uranyl germanate de cuivre Cu (H2 O)4 (U O2 H Ge O4)2 (H2 O)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1133","1139","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106549","8.179","","11.515","","19.397","","90","","90","","90","","1826.83","","","","","","","","","","","","","4","F d d d :1","F 2 2 -1d","70","","(U O2)2 Ge O4 (H2 O)2","","- Ge H4 O10 U2 -","- Ge O10 U2 -","- Ge8 O80 U16 -","8","0.25","","Legros, J.P.; Jeannin, Y.P.","Coordination de l'uranium par l'ion germanate. II. Structure du germanate d'uranyle dihydrate (U O2)2 Ge O4 (H2 O)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1140","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106551","9.21","","11.88","","10.08","","90","","93.1","","90","","1101.29","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Cd Cl2 (H2 O)2.5","","- Cd Cl2 H5 O2.5 -","- Cd Cl2 O2.5 -","- Cd8 Cl16 O20 -","8","2","","Leligny, H.; Monier, J.C.","Structure de Cd Cl2 (H2 O)2.5","Acta Crystallographica B (24,1968-38,1982)","1975","31","","728","732","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106552","4","","4","","25.32","","90","","90","","120","","350.844","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- In Se -","- In Se -","- In6 Se6 -","6","0.333333","","Likforman, A.; Carre, D.; Bachet, J.E.; Bachet, B.","Structure cristalline du monoseleniure d'indium In Se","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1252","1254","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106553","9.32","","9.32","","14.486","","90","","90","","120","","1089.71","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","Te4 O9","","- O9 Te4 -","- O9 Te4 -","- O54 Te24 -","6","0.333333","","Lindqvist, O.; Mark, W.; Moret, J.","The crystal structure of Te4 O9","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1255","1259","","","","","","","","","","","","","","","","","","","","","","has coordinates","151271","2020-10-21","18:00:00",""
"2106554","3.486","","3.486","","24.92","","90","","90","","120","","262.261","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(Yb0.5 Eu0.5) Fe2 O4","","- Eu0.5 Fe2 O4 Yb0.5 -","- Eu0.5 Fe2 O4 Yb0.5 -","- Eu1.5 Fe6 O12 Yb1.5 -","3","0.0833333","","Malaman, B.; Aubry, J.; Evrard, O.; Tannieres, N.","Structure cristalline de la phase Yb0.5 Eu0.5 Fe2 O4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1310","1312","","","","","","","","","","","","","","","","","","","","","","has coordinates","151308","2020-10-21","18:00:00",""
"2106555","17.539","","3.931","","12.847","","90","","108","","90","","842.395","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cu4 Bi5 S10","","- Bi5 Cu4 S10 -","- Bi5 Cu4 S10 -","- Bi10 Cu8 S20 -","2","0.25","","Mariolacos, K.; Kupcik, V.; Ohmasa, M.; Miehe, G.","The crystal structure of Cu4 Bi5 S10 and its relation to the structures of hodrushite and cuprobismutite","Acta Crystallographica B (24,1968-38,1982)","1975","31","","703","708","","","","","","","","","","","","","","","","","","","","","","has coordinates","151321","2020-10-21","18:00:00",""
"2106556","34.09","","34.09","","17.664","","90","","90","","120","","17777.6","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","Hf18 O10 (O H)26 (S O4)13 (H2 O)33","","- H92 Hf18 O121 S13 -","- Hf18 O121 S13 -","- Hf108 O726 S78 -","6","0.5","","Mark, W.; Hansson, M.","The crystal structure of Hf18 O10 (O H)26 (S O4)13 (H2 O)33","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1101","1108","","","","","","","","","","","","","","","","","","","","","","has coordinates","151323","2020-10-21","18:00:00",""
"2106563","12.248","","9.389","","3.975","","90","","90","","90","","457.111","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Co2 Y3 -","- Co2 Y3 -","- Co8 Y12 -","4","0.5","","Moreau, J.M.; Paccard, D.; Parthe, E.","The orthorombic structure of Y3 Co2, a shift structure variation of the monoclinic Dy3Ni2-type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","747","749","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106564","8.283","","7.05","","5.037","","85.4","","102.13","","110.29","","269.717","","","","","","","","","","","","","3","P -1","-P 1","2","","Li2 W2 O7","","- Li2 O7 W2 -","- Li2 O7 W2 -","- Li4 O14 W4 -","2","1","","Morikawa, H.; Okada, K.; Marumo, F.; Iwai, S.I.","The crystal structure of Li2 W2 O7","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1451","1454","","","","","","","","","","","","","","","","","","","","","","has coordinates","151373","2020-10-21","18:00:00",""
"2106565","9.787","","9.161","","5.296","","90","","111.42","","90","","442.035","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Zn Si O3","","- O3 Si Zn -","- O3 Si Zn -","- O24 Si8 Zn8 -","8","1","","Morimoto, N.; Akimoto, S.; Syono, Y.; Nakajima, Y.; Matsui, Y.","Crystal structures of pyroxene-type Zn Si O3 and Zn Mg Si2 O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1041","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106566","18.204","","9.087","","5.278","","90","","90","","90","","873.085","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Zn Si O3","","- O3 Si Zn -","- O3 Si Zn -","- O48 Si16 Zn16 -","16","2","","Morimoto, N.; Akimoto, S.; Syono, Y.; Nakajima, Y.; Matsui, Y.","Crystal structures of pyroxene-type Zn Si O3 and Zn Mg Si2 O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1041","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106567","18.201","","8.916","","5.209","","90","","90","","90","","845.317","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Zn Mg Si2 O6","","- Mg O6 Si2 Zn -","- Mg O6 Si2 Zn -","- Mg8 O48 Si16 Zn8 -","8","1","","Morimoto, N.; Nakajima, Y.; Syono, Y.; Akimoto, S.; Matsui, Y.","Crystal structures of pyroxene-type Zn Si O3 and Zn Mg Si2 O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1041","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106571","12.4","","15.65","","12.05","","90","","90","","90","","2338.42","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","K3 (Rh Cl6) (H2 O)","","- Cl6 H2 K3 O Rh -","- Cl6 H2 K3 O Rh -","- Cl48 H16 K24 O8 Rh8 -","8","1","","Murray-Rust, P.; Murray-Rust, J.","The structure of K3 Rh Cl6 (H2 O); a comparison of two independent X-ray structure determinations","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1037","1040","","","","","","","","","","","","","","","","","","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2106572","9.902","","18.7","","4.095","","90","","90","","90","","758.261","","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","Er Se F","","- Er F Se -","- Er F Se -","- Er12 F12 Se12 -","12","1.5","","Nguyen, H.D.; Dagron, C.; Laruelle, P.","Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ) . I. Structure cristalline du polytype orthorhombique a six couches du fluoroseleniure d'erbium Er Se F 60","Acta Crystallographica B (24,1968-38,1982)","1975","31","","514","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106573","9.962","","13.001","","4.106","","90","","90","","104.92","","513.864","","","","","","","","","","","","","3","P 1 1 21/m","-P 2c","11","","Y Se F","","- F Se Y -","- F Se Y -","- F8 Se8 Y8 -","8","2","","Nguyen, H.D.; Laruelle, P.; Dagron, C.","Etude structurale des polytypes a deux anions L Se F (L= Y, Ho, Er ). II. Structure cristalline du fluoroseleniure d'yttrium YSeF, polotype monoclinique a quatre couches 4m","Acta Crystallographica B (24,1968-38,1982)","1975","31","","519","521","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106575","7.216","","11.899","","14.716","","90","","90","","90","","1263.56","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Na2 (W2 O7)","","- Na2 O7 W2 -","- Na2 O7 W2 -","- Na16 O56 W16 -","8","","","Okada, K.; Morikawa, H.; Marumo, F.; Iwai, S.I.","Disodium ditungstate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1200","1201","","","","","","","","","","","","","","","","","","","","","","has coordinates","151425","2020-10-21","18:00:00",""
"2106579","10.091","","7.666","","7.866","","90","","106.66","","90","","582.952","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","Ga4 Fe3","","- Fe3 Ga4 -","- Fe3 Ga4 -","- Fe18 Ga24 -","6","0.75","","Philippe, M.J.; Roques, B.; Malaman, B.","Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","477","482","","","","","","","","","","","","","","","","","","","","","","has coordinates","151495","2020-10-21","18:00:00",""
"2106580","10.135","","7.845","","7.986","","90","","106","","90","","610.362","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Cr3 Ga4 -","- Cr3 Ga4 -","- Cr18 Ga24 -","6","0.75","","Philippe, M.J.; Roques, B.; Malaman, B.; Protas, J.; Courtois, A.","Structures cristallines des phases Fe3 Ga4 et Cr3 Ga4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","477","482","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106583","4.9776","","4.9776","","13.9647","","90","","90","","120","","299.642","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","V2 O3","","- O3 V2 -","- O3 V2 -","- O18 V12 -","6","0.166667","","Robinson, W.R.","High-temperature crystal chemistry of V2 O3 and 1% chromium- doped V2 O3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1153","1160","","","","","","","","","","","","","","","","","","","","","","has coordinates","151552","2020-10-21","18:00:00",""
"2106584","4.9974","","4.9974","","13.926","","90","","90","","120","","301.193","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","(Cr0.01 V0.99)2 O3","","- Cr0.02 O3 V1.98 -","- Cr0.02 O3 V1.98 -","- Cr0.12 O18 V11.88 -","6","0.166667","","Robinson, W.R.","High-temperature crystal chemistry of V2 O3 and 1% chromium-doped V2 O3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1153","1160","","","","","","","","","","","","","","","","","","","","","","has coordinates","151553","2020-10-21","18:00:00",""
"2106591","9.402","","17.846","","5.282","","90","","90","","90","","886.257","","","","","","","","","","","","","2","F d d d :2","-F 2uv 2vw","70","","","","- Co In2 -","- Co In2 -","- Co16 In32 -","16","0.5","","Stadelmaier, H.H.; Manaktala, H.K.","Intermetallic Co In2 , a representivtative of the Cu Mg2 structure type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","374","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106598","9.4845","","14.6836","","3.4355","","90","","90","","90","","478.45","","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","H N O3 (H2 O)3","","- H7 N O6 -","- H7 N O6 -","- H28 N4 O24 -","4","1","","Taesler, I.; Delaplane, R.G.; Olovsson, I.","Hydrogen bond studies. XCIV. Diaquaoxonium ion in nitric acid trihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1489","1492","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106599","11.219","","10.728","","10.685","","90","","90","","90","","1286.02","","","","","","","","","","","","","5","F m m m","-F 2 2","69","","K2 Ba (Cu (N O2)6)","","- Ba Cu K2 N6 O12 -","- Ba Cu K2 N6 O12 -","- Ba4 Cu4 K8 N24 O48 -","4","0.125","","Takagi, S.; Joesten, M.D.","Potassium barium hexanitrocuprate(II) at 295 K","Acta Crystallographica B (24,1968-38,1982)","1975","31","","596","598","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106604","6.96","","8.842","","5.504","","92.36","","119.09","","104.73","","280.768","","","","","","","","","","","","","4","P -1","-P 1","2","","Na (Cl O2) (H2 O)3","","- Cl H6 Na O5 -","- Cl H6 Na O5 -","- Cl2 H12 Na2 O10 -","2","1","","Tazzoli, V.; Riganti, V.; Giuseppetti, G.; Coda, A.","The crystal structure of sodium chlorite trihydrate, Na Cl O2 (H2 O)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1032","1037","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106607","5.44","","9.97","","12.17","","90","","92","","90","","659.66","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Xe F2 W O F4","","- F6 O W Xe -","- F6 O W Xe -","- F24 O4 W4 Xe4 -","4","1","","Tucker, P.A.; Taylor, P.A.; Holloway, J.H.; Russell, D.R.","The adduct Xe F2 W O F4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","906","908","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106617","11.2274","","11.2274","","11.2274","","90","","90","","90","","1415.26","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Na6 Mn Cl8","","- Cl8 Mn Na6 -","- Cl8 Mn Na6 -","- Cl32 Mn4 Na24 -","4","0.0208333","","van Loon, C.J.J.; Ijdo, D.J.W.","The crystal structures of Na6 Mn Cl8 and Na2 Mn3 Cl8 and some isostructural compounds","Acta Crystallographica B (24,1968-38,1982)","1975","31","","770","773","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106618","7.4563","","7.4563","","19.591","","90","","90","","120","","943.266","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Na2 Mn3 Cl8","","- Cl8 Mn3 Na2 -","- Cl8 Mn3 Na2 -","- Cl24 Mn9 Na6 -","3","0.0833333","","van Loon, C.J.J.; Ijdo, D.J.W.","The crystal structures of Na6 Mn Cl8 and Na2 Mn3 Cl8 and some isostructural compounds","Acta Crystallographica B (24,1968-38,1982)","1975","31","","770","773","","","","","","","","","","","","","","","","","","","","","","has coordinates","152004","2020-10-21","18:00:00",""
"2106654","9.811","","8.8","","5.139","","90","","90","","90","","443.685","","","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Li N2 H5 Be F4","","- Be F4 H5 Li N2 -","- Be F4 H5 Li N2 -","- Be4 F16 H20 Li4 N8 -","4","1","","Anderson, M.R.; Brown, I.D.","A neutron diffraction refinement of lithium hydrazinium fluoroberyllate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1500","1501","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106655","17.4","","11.9","","9.812","","90","","101","","90","","1994.34","","","","","","","","","","","","","6","P 1 c 1","P -2yc","7","","Co (S C (N H2)2)4 (N O3)2 (H2 O)0.5","","- C4 H17 Co N10 O6.5 S4 -","- C4 H16 Co N10 O6.5 S4 -","- C16 H64 Co4 N40 O26 S16 -","4","2","","Baggio, R.F.; Manzanares, C.; Baggio, S.","Tetrakis(thiourea)cobalt(II) nitrate hemihydrate = a monoclinic form","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2359","2361","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106658","8.815","","18.639","","5.934","","90","","90","","90","","974.973","","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Co Cl2 (N H3)4 H S O4","","- Cl2 Co H13 N4 O4 S -","- Cl2 Co H13 N4 O4 S -","- Cl8 Co4 H52 N16 O16 S4 -","4","1","","Bonapace, J.A.P.; Mandel, N.S.","Trans-dichlorotetraamminecobalt(III) bisulfate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2540","2542","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106659","20.86","","11.2","","6.61","","90","","90","","90","","1544.31","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","(N H4)6 (Au Cl4)3 Ag2 Cl5","","- Ag2 Au3 Cl17 H24 N6 -","- Ag2 Au3 Cl17 H24 N6 -","- Ag4 Au6 Cl34 H48 N12 -","2","0.125","","Bowles, J.C.; Hall, D.","Ammonium tris(tetrachloroaurate(III))mue-chloro-bis-(dichloroargent te)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2149","2150","","","","","","","","","","","","","","","","","","","","","","has coordinates","188927","2020-10-21","18:00:00",""
"2106660","14.005","","14.005","","9.405","","90","","90","","120","","1597.55","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Li2 (Cr O4)","","- Cr Li2 O4 -","- Cr Li2 O4 -","- Cr18 Li36 O72 -","18","1","","Brown, I.D.; Faggiani, R.","Refinement of the crystal structure of lithium chromate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2364","2365","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106662","5.446","","5.446","","8.082","","90","","90","","120","","207.589","","","","","","","","","","","","","4","P -3 1 m","-P 3 2","162","","Ba Sr Fe4 O8","","- Ba Fe4 O8 Sr -","- Ba Fe4 O8 Sr -","- Ba Fe4 O8 Sr -","1","0.0833333","","Cadee, M.C.","The crystal structure of hexagonal Ba Sr Fe4 O8","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2012","2015","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106663","7.221","","4.371","","9.534","","90","","108.45","","90","","285.454","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Al4 Co (B O4)2 O2","","- Al4 B2 Co O10 -","- Al4 B2 Co O10 -","- Al8 B4 Co2 O20 -","2","0.5","","Capponi, J.J.; Marezio, M.","The high-pressure synthesis and structural refinement of Al4 Co (B O4-582 O2, an anhydrous boron chododite","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2440","2443","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106666","8.923","","7.152","","9.548","","90","","90","","90","","609.328","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Na2 O)3 (B2 O3)3 (H2 O)2","","- B3 H2 Na3 O7 -","- B3 H2 Na3 O7 -","- B12 H8 Na12 O28 -","4","0.5","","Corazza, E.; Menchetti, S.; Sabelli, C.","The crystal structure of Na3 B3 O5 (O H)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1993","1997","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106667","10.745","","10.745","","5.719","","90","","90","","90","","660.287","","","","","","","","","","","","","2","I 4/m c m","-I 4 2c","140","","","","- Pu5 Ru3 -","- Pu5 Ru3 -","- Pu20 Ru12 -","4","0.125","","Cromer, D.T.; Larson, A.C.; Roof, R.B.jr.","The structure of Pu5 Ru3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1756","1757","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106668","8.49","","8.49","","6.084","","90","","90","","120","","379.783","","","","","","","","","","","","","2","P 63/m c m","-P 6c 2","193","","Pu5 Pt3","","- Pt3 Pu5 -","- Pt3 Pu5 -","- Pt6 Pu10 -","2","0.0833333","","Cromer, D.T.; Larson, A.C.","The structure of Pu5 Pt3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1758","1759","","","","","","","","","","","","","","","","","","","","","","has coordinates","154406","2020-10-21","18:00:00",""
"2106669","7.036","","4.55","","5.663","","90","","90","","90","","181.294","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","Pu Pd","","- Pd Pu -","- Pd Pu -","- Pd4 Pu4 -","4","0.5","","Cromer, D.T.","The structure of Pu Pd","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1760","1761","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106670","11.78","","6.81","","11.24","","90","","90.3","","90","","901.681","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Co0.25 Ti S2","","- Co0.25 S2 Ti -","- Co0.249 S2 Ti -","- Co3.984 S32 Ti16 -","16","2","","Danot, M.; Brec, R.","Structure cristalline de Co0.25 Ti S2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1647","1652","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106671","10.1192","","8.87","","7.7545","","90","","97.556","","90","","689.979","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","H C F3 S O3 (H2 O)2","","- C H5 F3 O5 S -","- C H5 F3 O5 S -","- C4 H20 F12 O20 S4 -","4","1","","Delaplane, R.G.; Olovsson, I.; Lundgren, J.O.","Hydrogen bond studies. XCVII. The crystal structure of trifluoromethanesulphonic acid dihydrate, H5 O2 C F3 S O3 at 225 and 85K","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2202","2207","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106672","10.048","","8.531","","4.466","","90","","90","","90","","382.823","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Fe3 B O6","","- B Fe3 O6 -","- B Fe3 O6 -","- B4 Fe12 O24 -","4","0.5","","Diehl, R.; Brandt, G.","Refinement of the crystal structure of Fe3 B O6","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1662","1665","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106673","6.72","","16.101","","11.436","","90","","90.88","","90","","1237.21","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- Ge S2 -","- Ge S2 -","- Ge16 S32 -","16","4","","Dittmar, G.; Schaefer, H.","Die Kristallstruktur von H.T.-Ge S2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2060","2064","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106675","5.761","","5.761","","7.374","","90","","90","","120","","211.948","","","","","","","","","","","","","5","P -3 m 1","-P 3 2""","164","","Na K3 (P O3 F)2","","- F2 K3 Na O6 P2 -","- F2 K3 Na O6 P2 -","- F2 K3 Na O6 P2 -","1","0.0833333","","Durand, J.; Granier, W.; le Cot, L.; Galigne, J.L.","Etudes structurales de composes oxyfluores du P(V). III. Structure cristalline de Na K3 (P O3 F)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1533","1535","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106676","9.532","","9.532","","6.199","","90","","90","","120","","487.776","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Mn5 (P O4)3 (Cl0.9 (O H)0.1)","","- Cl0.9 H0.1 Mn5 O12.1 P3 -","- Cl0.9 Mn5 O12.1 P3 -","- Cl1.8 Mn10 O24.2 P6 -","2","0.166667","","Engel, G.; Gramlich, V.; Pretzsch, J.; Baur, W.H.","The crystal structure of hydrothermally grown manganese chlorapatite, Mn5 (P O4)3 Cl0.9 (O H)0.1","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1854","1860","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106678","8.285","","8.285","","7.6","","90","","90","","120","","451.782","","","","","","","","","","","","","3","P 63","P 6c","173","","Na (Sb3 F10)","","- F10 Na Sb3 -","- F10 Na Sb3 -","- F20 Na2 Sb6 -","2","0.333333","","Fourcade, R.; Mascherpa, G.; Philippot, E.","Structure cristalline et moleculaire de Na Sb3 F10","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2322","2326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106680","8.87","","8.87","","5.215","","90","","90","","90","","410.3","","","","","","","","","","","","","3","P 4 b m","P 4 -2ab","100","","K2 V O (V2 O7)","","- K2 O8 V3 -","- K2 O8 V3 -","- K4 O16 V6 -","2","0.25","","Galy, J.; Carpy, A.","Structure cristalline de K2 V3 O8 ou K2 (V O) (V2 O7)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1794","1795","","","","","","","","","","","","","","","","","","","","","","has coordinates","154900","2020-10-21","18:00:00",""
"2106681","6.624","","8.637","","11.872","","90","","90","","90","","679.215","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Zr2 O (P O4)2","","- O9 P2 Zr2 -","- O9 P2 Zr2 -","- O36 P8 Zr8 -","4","","","Gebert, W.; Tillmanns, E.","Die Kristallstruktur von Dizirkondiorthophosphat","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1768","1770","","","","","","","","","","","","","","","","","","","","","","has coordinates","154914","2020-10-21","18:00:00",""
"2106682","6.065","","6.065","","11.615","","90","","90","","120","","370.008","","","","","","","","","","","","","3","P 63 c m","P 6c -2","185","","Y (Ga O3)","","- Ga O3 Y -","- Ga O3 Y -","- Ga6 O18 Y6 -","6","0.5","","Geller, S.; Jeffries, J.B.; Curlander, P.J.","The crystal structure of a new high-temperature modification of Y Ga O3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2770","2774","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106683","9.71","","9.71","","18.96","","90","","90","","120","","1548.13","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","K5 Fe3 (S O4)6 (O H)2 (H2 O)9","","- Fe3 H20 K5 O35 S6 -","- Fe3 K5 O35 S6 -","- Fe6 K10 O70 S12 -","2","0.166667","","Giacovazzo, C.; Scordari, F.; Menchetti, S.","Hydrous potassium and ferric iron sulphate (Maus's salt)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2171","2173","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106686","7.132","","7.132","","17.648","","90","","90","","90","","897.673","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","K4 W2 O Cl10","","- Cl10 K4 O W2 -","- Cl10 K4 O W2 -","- Cl20 K8 O2 W4 -","2","0.0625","","Glovyak, T.; Sabat, M.; Jezowska-Trzebiatowska, B.","Potassium mue-oxo-decachloroditungstate(IV)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1783","1784","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106687","8.165","","6.464","","7.786","","90","","90","","90","","410.934","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Rb P O2 F2","","- F2 O2 P Rb -","- F2 O2 P Rb -","- F8 O8 P4 Rb4 -","4","0.5","","Granier, W.; Durand, J.; le Cot, L.; Galigne, J.L.","Etudes structurales de composes oxyfluores du P(V). IV. Structure de Rb P O2 F2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2506","2507","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106688","8.633","","7.506","","6.256","","90","","103.8","","90","","393.683","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Hg2 (N O3)2 (H2 O)2","","- H4 Hg2 N2 O8 -","- Hg2 N2 O8 -","- Hg4 N4 O16 -","2","0.5","","Grdenic, D.; Sikirica, M.; Vickovic, I.","A redetermination of the crystal structure of mercury(I) nitrate dihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2174","2175","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2106689","6.389","","10.966","","6.613","","90","","115.65","","90","","417.661","","","","","","","","","","","","","2","P 1 21/m 1","-P 2yb","11","","","","- P4 S5 -","- P4 S5 -","- P8 S10 -","2","0.5","","Griffin, A.M.; Sheldrick, G.M.","Beta-tetraphophorus pentasulphide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2738","2740","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106692","3.78","","3.3","","7.91","","90","","90","","90","","98.669","","","","","","","","","","","","","3","P m m n :1","P 2 2ab -1ab","59","","V O Cl","","- Cl O V -","- Cl O V -","- Cl2 O2 V2 -","2","0.25","","Haase, A.; Brauer, G.","Vanadium oxychloride","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2521","2522","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106695","9.299","","4.736","","8.993","","90","","118.37","","90","","348.485","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Ba S2 -","- Ba S2 -","- Ba4 S8 -","4","0.5","","Kawada, I.; Yamaoka, S.; Kato, K.","Barium disulphide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2905","2906","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106697","8.1344","","8.2019","","6.8683","","96.238","","113.355","","106.192","","391.317","","","","","","","","","","","","","4","P -1","-P 1","2","","Ca2 V2 O7 (H2 O)2","","- Ca2 H4 O9 V2 -","- Ca2 H4 O9 V2 -","- Ca4 H8 O18 V4 -","2","1","","Konnert, Judith A.; Evans, Jr., Howard T.","Calcium divanadate dihydrate","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1975","31","11","2688","2690","10.1107/s0567740875008497","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106698","3.755","","3.755","","31.99","","90","","90","","120","","390.629","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ga Se -","- Ga Se -","- Ga8 Se8 -","8","0.666667","","Kuhn, A.; Chevalier, R.; Rimsky, A.","Atomic structure of a 4H Ga Se polytype named delta-type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2841","2842","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106700","7.175","","7.824","","12.318","","90","","99.66","","90","","681.693","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N2 H5 H S","","- H6 N2 S -","- H6 N2 S -","- H48 N16 S8 -","8","2","","Lazarini, F.; Vardjan-Jarec, M.","Hydrazinium(1+) hydrogen sulphide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2355","2356","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106701","6.66","","16.7","","6.538","","90","","90","","90","","727.169","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","Tl2 S5","","- S5 Tl2 -","- S5 Tl2 -","- S20 Tl8 -","4","1","","Leclerc, B.; Kabre, T.S.","Structure cristalline du sulfure de thallium Tl2 S5","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1675","1677","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106703","6.895","","11.9536","","34.518","","90","","90","","90","","2844.98","","","","","","","","","","","","","2","F 1 d 1","C -2yc (x+1/2*z,y,1/2*z)","9","","","","- Fe11 S12 -","- Fe11 S12 -","- Fe88 S96 -","8","","","Koto, K.; Morimoto, N.; Gyobu, A.","The superstructure of the intermediate pyrrhotite. I. Partially disordered distribution of metal vacancy in the 6C type, Fe~11~S~12~","Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry","1975","31","12","2759","2764","10.1107/s0567740875008849","","","","","","","","","","","","","","","","","","","","","has coordinates","278039","2022-09-21","12:15:31",""
"2106704","8.806","","10.836","","15.837","","112.57","","100.73","","120.39","","1057.63","","","","","","","","","","","","","5","P -1","-P 1","2","","K4 (Re2 O2 (C2 O4)4) (H2 O)3","","- C8 H6 K4 O21 Re2 -","- C8 K4 O21 Re2 -","- C16 K8 O42 Re4 -","2","1","","Lis, T.","The crystal and molecular structure of tetrapotassium muemue'-dioxo-tetraoxalatodirhenium(IV) trihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1594","1597","","","","","","","","","","","","","","","","","","","","","","has coordinates","155373","2020-10-21","18:00:00",""
"2106705","5.66","","5.66","","12.677","","90","","90","","90","","406.115","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","K Re O4","","- K O4 Re -","- K O4 Re -","- K4 O16 Re4 -","4","0.25","","Lock, C.J.L.; Turner, G.","A reinvestigation of the crystal structure of potassium perrhenate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1764","1765","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106706","5.6664","","11.496","","8.0983","","90","","90","","90","","527.531","","","","","","","","","","","","","4","P m m a","-P 2a 2a","51","","Ni10.3 Al11.3 Si2.4 O32","","- Al11.3 Ni10.3 O32 Si2.4 -","- Al11.3 Ni10.3 O32 Si2.4 -","- Al11.3 Ni10.3 O32 Si2.4 -","1","0.125","","Ma, C.; Sahl, K.; Tillmanns, E.","Nickel alumosilicate, phase I","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2137","2139","","","","","","","","","","","","","","","","","","","","","","has coordinates","155404","2020-10-21","18:00:00",""
"2106707","5.6603","","17.298","","8.11","","90","","90","","90","","794.065","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","Ni17 Al13.9 Si5.1 O48","","- Al13.9 Ni17 O48 Si5.1 -","- Al13.9 Ni17 O48 Si5.1 -","- Al13.9 Ni17 O48 Si5.1 -","1","0.0625","","Ma, C.; Tillmanns, E.","Nickel alumosilicate, phase II","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2139","2141","","","","","","","","","","","","","","","","","","","","","","has coordinates","155405","2020-10-21","18:00:00",""
"2106708","5.6646","","11.455","","8.1007","","90","","90","","90","","525.638","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","Ni12.48 (Al7 Si4.5 O32)","","- Al7 Ni12.48 O32 Si4.5 -","- Al7 Ni12.48 O32 Si4.5 -","- Al7 Ni12.48 O32 Si4.5 -","1","0.0625","","Ma, C.; Sahl, K.","Nickel alumosilicate, phase III","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2142","2143","","","","","","","","","","","","","","","","","","","","","","has coordinates","155406","2020-10-21","18:00:00",""
"2106709","7.365","","8.287","","6.691","","102.96","","72.73","","95.01","","379.938","","","","","","","","","","","","","4","P -1","-P 1","2","","Ca2 P2 O7 (H2 O)2","","- Ca2 H4 O9 P2 -","- Ca2 H4 O9 P2 -","- Ca4 H8 O18 P4 -","2","1","","Mandel, N.S.","The crystal structure of calcium pyrophosphate dihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1730","1734","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106710","20.929","","10.44","","4.015","","90","","90","","90","","877.273","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bi2 Cu3 S4 Br","","- Bi2 Br Cu3 S4 -","- Bi2 Br Cu3 S4 -","- Bi8 Br4 Cu12 S16 -","4","1","","Mariolacos, K.; Kupcik, V.","Die Kristallstruktur des Bi2 Cu3 S4 Br","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1762","1763","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106711","7.409","","7.409","","4.309","","90","","90","","90","","236.535","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","K2 Pd Br4","","- Br4 K2 Pd -","- Br4 K2 Pd -","- Br4 K2 Pd -","1","0.0625","","Martin, D.S.; Bonte, J.L.; Rush, R.M.; Jacobson, R.A.","Potassium tetrabromopalladate(II)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2538","2539","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106712","7.687","","7.941","","8.057","","90","","91.61","","90","","491.625","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Pt (N H3)4 Cu Cl4","","- Cl4 Cu H12 N4 Pt -","- Cl4 Cu H12 N4 Pt -","- Cl8 Cu2 H24 N8 Pt2 -","2","0.5","","Morosin, B.; Fallon, P.; Valentine, J. S.","Structures of Becton's Pt (N H3)4 Cu Cl4 and Millon's Cu (N H3 )4 Pt Cl4 salts","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2220","2223","","","","","","","","","","","","","","","","","","","","","","has coordinates","189062","2020-10-21","18:00:00",""
"2106713","9.036","","9.036","","6.441","","90","","90","","90","","525.903","","","","","","","","","","","","","5","P 4/m n c","-P 4 2n","128","","(Cu (N H3)4) (Pt Cl4)","","- Cl4 Cu H12 N4 Pt -","- Cl4 Cu H12 N4 Pt -","- Cl8 Cu2 H24 N8 Pt2 -","2","0.125","","Morosin, B.; Valentine, J. S.; Fallon, P.","Structures of Becton's Pt (N H3)4 Cu Cl4 and Millon's Cu (N H3)4 Pt Cl4 salts","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2220","2223","","","","","","","","","","","","","","","","","","","","","","has coordinates","189062","2020-10-21","18:00:00",""
"2106714","21.81","","21.81","","21.81","","90","","90","","90","","10374.5","","","","","","","","","","","","","5","F d -3 c :2","-F 4ud 2vw 3","228","","Co (N H3)6 Cu0.72 Cu0.28 Cl5","","- Cl5 Co Cu H18 N6 -","- Cl5 Co Cu1.04 N6 -","- Cl160 Co32 Cu33.28 N192 -","32","0.166667","","Murray-Rust, P.","X-ray crystallographic investigation of the mixed-valence hexaamminocobalt(iii) chlorocuprates(i, ii).","Acta Crystallographica B (24,1968-38,1982)","1975","31","","978","981","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106715","7.621","","11.761","","6.731","","92.77","","95.08","","106.87","","573.336","","","","","","","","","","","","","2","P -1","-P 1","2","","(Li0.55 Na0.45) Mn4 (Si5 O14 (O H))","","- O15 Si5 -","- O15 Si5 -","- O30 Si10 -","2","1","","Narita, H.; Yoshii, M.; Koto, K.; Morimoto, N.","The crystal structure of nambulite (Li, Na) Mn4 Si5 O14 (O H)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2422","2426","","","","","","","","","","","","","","","","","","","","","","has coordinates","155596","2020-10-21","18:00:00",""
"2106716","13.29","","8.423","","10.427","","90","","101.35","","90","","1144.39","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cr U8 S17","","- Cr S17 U8 -","- Cr S17 U8 -","- Cr2 S34 U16 -","2","0.25","","Noel, H.; Potel, M.; Padiou, J.","Structure cristalline de Cr U8 S17","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2634","2637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106719","8.625","","8.866","","7.062","","112.17","","108.54","","98.49","","451.584","","","","","","","","","","","","","4","P -1","-P 1","2","","Bi H (P O3)4","","- Bi H O12 P4 -","- Bi H O12 P4 -","- Bi2 H2 O24 P8 -","2","1","","Palinka, K.; Jost, K.H.","Crystal structure of the polyphosphate (Bi H (P O3)4)X","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2285","2290","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106720","13.732","","6.933","","7.152","","90","","93.35","","90","","679.735","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Bi (P O3)3","","- Bi O9 P3 -","- Bi O9 P3 -","- Bi4 O36 P12 -","4","1","","Palkina, K.; Jost, K.H.","Crystal structure of bismuth polyphosphate, Bi(P O3)3","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2281","2285","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106721","5.754","","5.978","","8.557","","90","","91","","90","","294.294","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Zn (N O3)2 (H2 O)2","","- H4 N2 O8 Zn -","- N2 O8 Zn -","- N4 O16 Zn2 -","2","0.5","","Petrovic, D.; Ribar, B.","A redertimination of the crystal structure of Zn (N O3) (H2 O)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1795","1796","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106722","20.825","","4.536","","14.368","","90","","109.33","","90","","1280.72","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(N H2 C S N H)2","","- C2 H6 N4 S2 -","- C2 H6 N4 S2 -","- C16 H48 N32 S16 -","8","1","","Pignedoli, A.; Peyronel, G.; Antolini, L.","The crystal structure of dithiobiurea, N,N' - bis(thiocarbamoyl) hydrazine, (N H2 C S N H)2","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1903","1906","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106723","5.743","","4.915","","9.361","","90","","90","","90","","264.231","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- Co2 Mn3 O8 -","- Co2 Mn3 O8 -","- Co4 Mn6 O16 -","2","0.5","","Riou, A.; Lecerf, A.","Structure cristalline de Co2 Mn3 O8","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2487","2490","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106724","12.56","","9.501","","11.423","","90","","90","","90","","1363.14","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","N H4 Al2 Br7","","- Al2 Br7 H4 N -","- Al2 Br7 H4 N -","- Al8 Br28 H16 N4 -","4","1","","Rytter, E.; Rytter, B. E. D.; Oye, H. A.","The crystal structure of ammonium heptabromodialuminate N H4 Al2 Br7","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2177","2181","","","","","","","","","","","","","","","","","","","","","","has coordinates","189062","2020-10-21","18:00:00",""
"2106725","7.232","","3.468","","14.82","","90","","90","","90","","371.694","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","In2 V O5","","- In2 O5 V -","- In2 O5 V -","- In8 O20 V4 -","4","0.5","","Senegas, J.; Manaud, J.P.; Galy, J.","Sur un nouveau type d'oxydes doubles M(IV) In2 O5 (M = Ti, V): etude cristallochimique","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1614","1618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106726","7.719","","7.719","","5.455","","90","","90","","120","","281.48","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Li Cl O4 (H2 O)3","","- Cl H6 Li O7 -","- Cl H6 Li O7 -","- Cl2 H12 Li2 O14 -","2","0.166667","","Sequeira, A.; Bernal, I.; Faggiani, R.; Brown, I.D.","The structure of lithium perchlorate trihydrate Li (H2 O)3 Cl O4 - an X-ray and neutron diffraction study","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1735","1739","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106728","11.668","","9.824","","6.316","","90","","99.43","","90","","714.197","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Mn Br2 (H2 O)4","","- Br2 H8 Mn O4 -","- Br2 H8 Mn O4 -","- Br8 H32 Mn4 O16 -","4","1","","Sudarsanan, K.","Manganese bromide tetrahydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2720","2721","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106729","10.5775","","10.5775","","10.5775","","90","","90","","90","","1183.45","","","","","","","","","","","","","5","F m -3","-F 2 2 3","202","","K2 Pb Ni (N O2)6","","- K2 N6 Ni O12 Pb -","- K2 N6 Ni O12 Pb -","- K8 N24 Ni4 O48 Pb4 -","4","0.0416667","","Takagi, S.; Joesten, M.D.; Lenhert, P.G.","Potassium lead hexanitroniccolate(II)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1968","1970","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106730","10.78","","10.78","","10.78","","90","","90","","90","","1252.73","","","","","","","","","","","","","5","F m -3","-F 2 2 3","202","","K2 Ba (Ni (N O2)6)","","- Ba K2 N6 Ni O12 -","- Ba K2 N6 Ni O12 -","- Ba4 K8 N24 Ni4 O48 -","4","0.0416667","","Takagi, S.; Lehnert, P.G.; Joesten, M.D.","Potassium barium hexanitroniccolate(II)","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1970","1972","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106731","5.492","","6.412","","8.832","","72.06","","87.73","","70.88","","278.921","","","","","","","","","","","","","4","P -1","-P 1","2","","Na (Cl O2) (H2 O)3","","- Cl H6 Na O5 -","- Cl H6 Na O5 -","- Cl2 H12 Na2 O10 -","2","1","","Tarimci, C.; Schempp, E.","Sodium chlorite trihydrate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2146","2149","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106736","9.269","","12.5405","","6.1357","","90","","106.8","","90","","682.761","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","Co (N H4)2 (Be F4)2 (H2 O)6","","- Be2 Co F8 H20 N2 O6 -","- Be2 Co F8 H20 N2 O6 -","- Be4 Co2 F16 H40 N4 O12 -","2","0.5","","Vicat, J.; Duc Tran Qui; Filhol, A.; Aleonard, S.; Roudaut, E.; Thomas, M.","Structure cristalline de l'orthofluoroberyllate Co (N H4)2 (Be F4)2 (H2 O)6 par diffraction neutronique","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1895","1903","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106737","16.05","","16.63","","13.14","","90","","90","","108.1","","3333.67","","","","","","","","","","","","","5","B 1 1 b","B -2b","9","","(C (N H2)3)6 (Ce (C O3)5) (H2 O)4","","- C11 H44 Ce N18 O19 -","- C11 Ce N18 O19 -","- C44 Ce4 N72 O76 -","4","1","","Voliotis, S.; Rimsky, A.; Faucherre, J.","Etude structurale des carbonates complexes de cerium et de thorium. I. Structure cristalline et moleculaire du pentacarbonatocerate de guanidine tetrahydrate, (C (N H2)3)6 Ce (C O3)5 (H2 O)4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2607","2611","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106738","16.15","","16.7","","13.23","","90","","90","","108.41","","3385.58","","","","","","","","","","","","","5","B 1 1 b","B -2b","9","","(C (N H2)3)6 (Th (C O3)5) (H2 O)4","","- C11 H44 N18 O19 Th -","- C11 H44 N18 O19 Th -","- C44 H176 N72 O76 Th4 -","4","1","","Voliotis, S.; Rimsky, A.","Etude structurale des carbonates complexes de cerium et de thorium II. Structure cristalline et moleculaire du pentacarbonatothorate de guanidine tetrahydrate, (C (N H2)3)6 Th (C O3)5 (H2 O)4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2612","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","189298","2020-10-21","18:00:00",""
"2106739","9.6","","9.92","","13.64","","90.47","","104.38","","95.52","","1251.74","","","","","","","","","","","","","5","P -1","-P 1","2","","Na6 Th (C O3)5 (H2 O)12","","- C5 H24 Na6 O27 Th -","- C5 H24 Na6 O27 Th -","- C10 H48 Na12 O54 Th2 -","2","1","","Voliotis, S.; Rimsky, A.","Etude structurale des carbonates complexes de cerium et de thorium. III. Structure cristalline et moleculaire du pentacarbonatothorate de sodium dodecahydrate, Na6 Th (C O3)5 (H2 O)12","Acta Crystallographica B (24,1968-38,1982)","1975","31","11","2615","2620","10.1107/S056774087500831X","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106740","9.53","","9.84","","13.58","","90.46","","104.5","","95.42","","1226.73","","","","","","","","","","","","","5","P -1","-P 1","2","","Na6 Ce (C O3)5 (H2 O)12","","- C5 H24 Ce Na6 O27 -","- C5 Ce Na6 O27 -","- C10 Ce2 Na12 O54 -","2","1","","Voliotis, S.; Rimsky, A.","Etude structurale des carbonates complexes de cerium et de thorium. IV. Structure cristalline et moleculaire du pentacarbonatocerate de sodium dodecahydrate, Na6 Ce (C O3)5 (H2 O)12","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2620","2622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106741","10.224","","10.224","","5.189","","90","","90","","90","","542.407","","","","","","","","","","","","","2","P 42/n :2","-P 4bc","86","","","","- Nb3 Si -","- Nb3 Si -","- Nb24 Si8 -","8","1","","Waterstrat, R.M.; Flack, H.D.; Yvon, K.; Parthe, E.","Refinement of Nb3 Si Nb3 As","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2765","2769","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106742","13.38","","4.09","","5.66","","90","","90","","90","","309.739","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Na (S C N)","","- C N Na S -","- C N Na S -","- C4 N4 Na4 S4 -","4","0.5","","van Rooyen, P.H.; Boeyens, J.C.A.","Sodium thiocyanate","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2933","2934","","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:19:25",""
"2106743","10.294","","10.294","","5.199","","90","","90","","90","","550.92","","","","","","","","","","","","","2","P 42/n :2","-P 4bc","86","","Nb3 As","","- As Nb3 -","- As Nb3 -","- As8 Nb24 -","8","1","","Waterstrat, R.M.; Yvon, K.; Flack, H.D.; Parthe, E.","Refinement of Nb3 Si Nb3 As","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2765","2769","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106744","45.75","","22.87","","4.0023","","90","","90","","90","","4187.62","","","","","","","","","","","","","3","P b 21 a","P -2a -2ab","29","","(Mo0.93 Ta0.07)5 O14","","- Mo4.65 O14 Ta0.35 -","- Mo4.65 O14 Ta0.35 -","- Mo74.4 O224 Ta5.6 -","16","4","","Yamazoe, N.; Kihlborg, L.","Mo5 O14 - twinning and three-dimensional structure, determined from a partly tantalum-substituted crystal","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1666","1672","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2106745","10.601","","11.112","","19.661","","90","","90","","90","","2316.03","","","","","","","","","","","","","3","I b c a","-I 2b 2c","73","","","","- Bi P S4 -","- Bi P S4 -","- Bi16 P16 S64 -","16","1","","Zimmermann, H.; Nitsche, R.; Carpentier, C.D.","The crystal structure of bismuth thiophosphate Bi P S4","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2003","2006","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2107168","17.52","","3.912","","15.24","","90","","101.26","","90","","1024.42","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Cu4 Bi7 S12","","- Bi7 Cu4 S12 -","- Bi7 Cu4 S12 -","- Bi14 Cu8 S24 -","2","0.25","","Mariolacos, K.; Kupcik, V.; Miehe, G.; Ohmasa, M.","The crystal structure of Cu4 Bi5 S10 and its relation to the structures of hodrushite and cuprobismutite","Acta Crystallographica B (24,1968-38,1982)","1975","31","","703","708","","","","","","","","","","","","","","","","","","","","","","has coordinates","167434","2020-10-21","18:00:00",""
"2107311","10.278","","10.278","","9.6069","","90","","90","","120","","878.883","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","Pr7 O12","","- O12 Pr7 -","- O12 Pr7 -","- O36 Pr21 -","3","0.166667","","von Dreele, R.B.; Eyring, L.; Bowman, A.L.; Yarnell, J.L.","Refinement of the crystal structure of Pr7 O12 by powder neutron diffraction","Acta Crystallographica B (24,1968-38,1982)","1975","31","","971","974","","","","","","","","","","","","","","","","","","","","","","has coordinates","172034","2020-10-21","18:00:00",""
"2310239","3.88","","3.88","","3.88","","90","","90","","90","","58.411","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Nb Ru3 -","- Nb Ru3 -","- Nb Ru3 -","1","0.0208333","","Popova, S.V.","The crystal structures of new superconducting materials obtained by high pressure treatment","Acta Crystallographica A (24,1968-38,1982)","1975","31","","99","99","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310293","4.744","","4.744","","4.744","","90","","90","","90","","106.766","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","(Fe0.8 V2.2) Ga","","- Fe0.8 Ga V2.2 -","- Fe0.801 Ga V2.199 -","- Fe1.602 Ga2 V4.398 -","2","0.0416667","","Girgis, K.","Chrystallographic studies on ternary superconductors of the A15 type","Acta Crystallographica A (24,1968-38,1982)","1975","31","","899","899","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310295","3.6573","","3.6573","","3.6573","","90","","90","","90","","48.919","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","(Cu0.85 Ga0.15)","","- Cu0.85 Ga0.15 -","- Cu0.85 Ga0.15 -","- Cu3.4 Ga0.6 -","4","0.0208333","","Halder, S.K.; Sen Gupta, S.P.","An X-ray determination of the thermal expansion of silver and copper base alloys at high temperatures. II. Cu - Ga","Acta Crystallographica A (24,1968-38,1982)","1975","31","","158","159","","","","","","","","","","","","","","","","","","","","","","has coordinates","145255","2020-10-21","18:00:00",""
"2310957","4.358","","4.358","","4.358","","90","","90","","90","","82.768","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Ta N","","- N Ta -","- N Ta -","- N4 Ta4 -","4","0.0208333","","Popova, S.V.","The crystal structures of new superconducting meterials obtained by high pressure treatment","Acta Crystallographica A (24,1968-38,1982)","1975","31","","S99","S99","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310995","4.04","","4.04","","6.71","","90","","90","","120","","94.845","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","","","- Ni Se -","- Ni Se -","- Ni2 Se2 -","2","0.0833333","","Srivastava, M.M.; Srivastava, O.N.","Studies of structure, electrical resistivity, and modulated structures in Fe Se and Ni Se alloys","Acta Crystallographica A (24,1968-38,1982)","1975","31","","S82","S82","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2311059","7.8567","","7.767","","7.8478","","90","","90.856","","90","","478.843","","","","","","","","","","","","","4","P 1 m 1","P -2y","6","","(Na0.98 K0.02) (Nb O3)","","- K0.02 Na0.98 Nb O3 -","- K0.02 Na0.98 Nb O3 -","- K0.16 Na7.84 Nb8 O24 -","8","4","","Ahtee, M.; Hewat, A.W.","The structures of Na0.98 K0.02 Nb O3 and Na0.9 K0.1 Nb O3 (phase Q) at room temperature by neutron powder diffraction","Acta Crystallographica A (24,1968-38,1982)","1975","31","","846","850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311060","7.8782","","7.792","","7.8632","","90","","90.479","","90","","482.681","","","","","","","","","","","","","4","P 1 m 1","P -2y","6","","Na.90 K.10 Nb O3","","- K0.1 Na0.9 Nb O3 -","- K0.1 Na0.9 Nb O3 -","- K0.8 Na7.2 Nb8 O24 -","8","4","","Ahtee, M.; Hewat, A.W.","The Structures of Na.98 K.02 Nb O3 and Na.90 K.10 Nb O3 (Phase Q) at Room Temperature by Neutron Powder Diffraction","Acta Crystallographica A (24,1968-38,1982)","1975","31","","846","850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"3000559","6.9875","0.0001","15.1552","0.0003","19.5219","0.0004","78.119","0.002","84.652","0.002","88.58","0.002","2014.18","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17.34 H18.5 N4.17 O7.5 -","- C17.337 H18.5055 N4.1685 O7.5 -","- C69.348 H74.022 N16.674 O30 -","4","2","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","x-ray","0.812","synchrotron","","0.0694","0.0667","","","0.1886","0.1916","","","","","","1.036","","","","has coordinates,has disorder","299263","2025-04-11","08:37:10",""
"3000560","27.933","","15.206","","7.146","","90","","109.13","","90","","2867.64","","79","","79","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12.29 H11.76 N2.29 O7.18 -","- C12.29 H11.73 N2.29 O7.19 -","- C98.32 H93.84 N18.32 O57.52 -","8","1","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.02508","electrons","","0.2584","0.1444","","","0.3735","0.409","","","","","","0.978","","","","has coordinates,has disorder","303248","2025-11-11","13:45:17",""
"3000561","7.003","","15.214","","27.473","","90","","86.94","","90","","2922.9","","79","","79","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13.75 H14 N2 O7 -","- C13.75 H14 N2 O7 -","- C110 H112 N16 O56 -","8","2","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.02508","electrons","","0.2627","0.154","","","0.3759","0.3972","","","","","","0.975","","","","has coordinates,has disorder","303248","2025-11-11","13:45:18",""
"3000562","7.507","0.019","11.44","0.03","15.4","0.04","102.48","0.03","101.82","0.03","98.28","0.05","1239","6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H44 N11 O20 -","- C43 H44 N11 O20 -","- C43 H44 N11 O20 -","1","0.5","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.71073","MoKα","","0.0926","0.0801","","","0.248","0.2709","","","","","","1.056","","","","has coordinates,has disorder","297458","2025-01-24","06:20:57",""
"4002903","6.242","0.004","22.545","0.013","9.236","0.005","90","","94.648","0.013","90","","1295.5","1.3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br4 N2 Pb -","- C4 H12 Br4 N2 Pb -","- C16 H48 Br16 N8 Pb4 -","4","1","","Li, Xiaotong; Guo, Peijun; Kepenekian, Mikaël; Hadar, Ido; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G.","Small Cyclic Diammonium Cation Templated (110)-Oriented 2D Halide (X = I, Br, Cl) Perovskites with White-Light Emission","Chemistry of Materials","2019","31","9","3582","","10.1021/acs.chemmater.9b01511","","x-ray","0.71073","MoKα","","0.0598","0.0402","","","0.0885","0.0898","","","","2.22","2.22","1.91","","","","has coordinates","223183","2020-10-21","18:00:00",""
"4002904","6.2763","0.0003","20.46","0.0009","9.6935","0.0004","90","","90.563","0.002","90","","1244.71","0.1","250","","250","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br4 N2 Pb -","- C4 H12 Br4 N2 Pb -","- C16 H48 Br16 N8 Pb4 -","4","1","","Li, Xiaotong; Guo, Peijun; Kepenekian, Mikaël; Hadar, Ido; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G.","Small Cyclic Diammonium Cation Templated (110)-Oriented 2D Halide (X = I, Br, Cl) Perovskites with White-Light Emission","Chemistry of Materials","2019","31","9","3582","","10.1021/acs.chemmater.9b01511","","x-ray","0.71073","MoKα","","0.0314","0.0288","","","0.082","0.0826","","","","2.2","2.2","2.15","","","","has coordinates","223183","2020-10-21","18:00:00",""
"4002905","10.057","0.002","21.376","0.003","6.58","0.007","90","","90","","90","","1414.6","1.5","298","","298","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C4 H12 I4 N2 Pb -","- C4 H12 I4 N2 Pb -","- C16 H48 I16 N8 Pb4 -","4","1","","Li, Xiaotong; Guo, Peijun; Kepenekian, Mikaël; Hadar, Ido; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G.","Small Cyclic Diammonium Cation Templated (110)-Oriented 2D Halide (X = I, Br, Cl) Perovskites with White-Light Emission","Chemistry of Materials","2019","31","9","3582","","10.1021/acs.chemmater.9b01511","","x-ray","0.71073","MoKα","","0.0377","0.0304","","","0.0402","0.041","","","","1.44","1.44","1.36","","","","has coordinates","223183","2020-10-21","18:00:00",""
"4002906","5.886","0.0002","21.7573","0.0007","8.9772","0.0003","90","","94.922","0.002","90","","1145.41","0.07","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cl4 N2 Pb -","- C4 H12 Cl4 N2 Pb -","- C16 H48 Cl16 N8 Pb4 -","4","1","","Li, Xiaotong; Guo, Peijun; Kepenekian, Mikaël; Hadar, Ido; Katan, Claudine; Even, Jacky; Stoumpos, Constantinos C.; Schaller, Richard D.; Kanatzidis, Mercouri G.","Small Cyclic Diammonium Cation Templated (110)-Oriented 2D Halide (X = I, Br, Cl) Perovskites with White-Light Emission","Chemistry of Materials","2019","31","9","3582","","10.1021/acs.chemmater.9b01511","","x-ray","0.71073","MoKα","","0.0421","0.0397","","","0.1018","0.1023","","","","2.53","2.53","2.47","","","","has coordinates","223183","2020-10-21","18:00:00",""
"4002907","8.8027","0.0004","8.8027","0.0004","12.7893","0.0006","90","","90","","120","","858.24","0.07","293","","293","","","","","","","","","5","P 64","P 64","172","catena-(tetrakis(m2-2-trifluoromethylimidazolato)-di-zinc)","","","- C8 H4 F6 N4 Zn -","- C8 H4 F6 N4 Zn -","- C24 H12 F18 N12 Zn3 -","3","0.5","","Arhangelskis, Mihails; Katsenis, Athanassios D.; Novendra, Novendra; Akimbekov, Zamirbek; Gandrath, Dayaker; Marrett, Joseph M.; Ayoub, Ghada; Morris, Andrew J.; Farha, Omar K.; Friščić, Tomislav; Navrotsky, Alexandra","Theoretical Prediction and Experimental Evaluation of Topological Landscape and Thermodynamic Stability of a Fluorinated Zeolitic Imidazolate Framework","Chemistry of Materials","2019","31","10","3777","","10.1021/acs.chemmater.9b00994","powder diffraction","","1.5418","CuKα~1~","","","","","","","","","0.018","10.224","","","","","","","has coordinates","288246","2023-12-12","10:54:34",""
"4002908","17.5317","0.0008","17.5317","0.0008","17.5317","0.0008","90","","90","","90","","5388.6","0.4","293","","293","","","","","","","","","5","I -4 3 m","I -4 2 3","217","catena-(tetrakis(m2-2-trifluoromethylimidazolato)-di-zinc)","","","- C8 H4 F6 N4 Zn -","- C8 H4 F6 N4 Zn -","- C96 H48 F72 N48 Zn12 -","12","0.25","","Arhangelskis, Mihails; Katsenis, Athanassios D.; Novendra, Novendra; Akimbekov, Zamirbek; Gandrath, Dayaker; Marrett, Joseph M.; Ayoub, Ghada; Morris, Andrew J.; Farha, Omar K.; Friščić, Tomislav; Navrotsky, Alexandra","Theoretical Prediction and Experimental Evaluation of Topological Landscape and Thermodynamic Stability of a Fluorinated Zeolitic Imidazolate Framework","Chemistry of Materials","2019","31","10","3777","","10.1021/acs.chemmater.9b00994","powder diffraction","","1.5418","CuKα~1~","","","","","","","","","0.021","10.727","","","","","","","has coordinates,has disorder","288246","2023-12-12","10:54:34",""
"4002909","7.5862","0.0016","9.8792","0.0018","7.6926","0.0018","90","","108.97","0.018","90","","545.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H3 F3 N2 -","- C4 H3 F3 N2 -","- C16 H12 F12 N8 -","4","1","","Arhangelskis, Mihails; Katsenis, Athanassios D.; Novendra, Novendra; Akimbekov, Zamirbek; Gandrath, Dayaker; Marrett, Joseph M.; Ayoub, Ghada; Morris, Andrew J.; Farha, Omar K.; Friščić, Tomislav; Navrotsky, Alexandra","Theoretical Prediction and Experimental Evaluation of Topological Landscape and Thermodynamic Stability of a Fluorinated Zeolitic Imidazolate Framework","Chemistry of Materials","2019","31","10","3777","","10.1021/acs.chemmater.9b00994","","","1.54178","CuKα","","0.1909","0.0825","","","0.1868","0.2401","","","","","","1.031","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002910","13.279","","4.066","","14.988","","90","","115.43","","90","","730.832","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Bi3.48 In0.51 Mn2.03 Se8 -","- Bi3.48 In0.52 Mn2.03 Se8 -","- Bi6.96 In1.04 Mn4.06 Se16 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.0783","0.0727","","","0.1804","0.1908","","","","","","0.827","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002911","13.684","","4.16","","17.082","","90","","94.05","","90","","969.972","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ag1.61 Bi5.46 Cd0.94 Se10 -","- Ag1.52 Bi5.454 Cd1.026 Se10 -","- Ag3.04 Bi10.908 Cd2.052 Se20 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.0651","0.059","","","0.1638","0.1711","","","","","","1.08","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002912","13.547","","4.087","","20.706","","90","","102.36","","90","","1119.85","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ag2.36 Cd0.96 Sb6.53 Se12 -","- Ag2.354 Cd0.96 Sb6.526 Se12 -","- Ag4.708 Cd1.92 Sb13.052 Se24 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.0643","0.0477","","","0.1248","0.1324","","","","","","1.035","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002913","13.014","","3.991","","12.003","","90","","104.23","","90","","604.294","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Bi3 In Pb S7 -","- Bi3 In Pb S7 -","- Bi6 In2 Pb2 S14 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.0345","0.0342","","","0.0983","0.0986","","","","","","1.095","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002914","13.633","","4.146","","19.335","","90","","104.64","","90","","1057.38","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ag2 Bi6 Cd Se11 -","- Ag2 Bi6 Cd Se11 -","- Ag4 Bi12 Cd2 Se22 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.1345","0.0595","","","0.1331","0.1572","","","","","","0.741","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002915","13.156","","4.011","","15.151","","90","","99.87","","90","","787.666","","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Bi4 Cd Pb2 S9 -","- Bi4 Cd Pb2 S9 -","- Bi8 Cd2 Pb4 S18 -","2","0.25","","Zhao, Jing; Hao, Shiqiang; Islam, Saiful M.; Chen, Haijie; Tan, Gangjian; Ma, Shulan; Wolverton, Christopher; Kanatzidis, Mercouri G.","Six Quaternary Chalcogenides of the Pavonite Homologous Series with Ultralow Lattice Thermal Conductivity","Chemistry of Materials","2019","31","9","3430","","10.1021/acs.chemmater.9b00585","","","0.71069","MoKα","","0.0656","0.0544","","","0.1287","0.1345","","","","","","1.052","","","","has coordinates","223184","2020-10-21","18:00:00",""
"4002916","6.83148","0.00011","6.83148","0.00011","5.6572","0.0002","90","","90","","90","","264.017","0.011","295","","295","","","","8700000","","","","","2","I 4/m c m","-I 4 2c","140","","","MnBi2","- Bi2 Mn -","- Bi2 Mn -","- Bi8 Mn4 -","4","0.125","","Walsh, James P. S.; Clarke, Samantha M.; Puggioni, Danilo; Tamerius, Alexandra D.; Meng, Yue; Rondinelli, James M.; Jacobsen, Steven D.; Freedman, Danna E.","MnBi2: A Metastable High-Pressure Phase in the Mn‒Bi System","Chemistry of Materials","2019","31","9","3083","","10.1021/acs.chemmater.9b00385","powder diffraction","","0.4066","","","3.513","","","","","","","","0.8","","","","","","","has coordinates","223185","2020-10-21","18:00:00",""
"4002917","16.5896","0.0004","6.1155","0.0001","18.1992","0.0004","90","","90","","90","","1846.38","0.07","299.78","0.1","299.78","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,3-dibromo-5.6-dicyanobenzoquinone","","- C8 Br2 N2 O2 -","- C8 Br2 N2 O2 -","- C64 Br16 N16 O16 -","8","1","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0302","0.0262","","","0.0655","0.0684","","","","","","1.0456","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002918","6.57483","0.00012","18.364","0.0003","16.5153","0.0002","90","","90","","90","","1994.06","0.05","298.62","0.1","298.62","0.1","","","","","","","","6","C m c 21","C 2c -2","36","","2,3,-dichloro-5,6-dicyanobenzoquinone 4,6-dimethyldibenzothiophene","","- C22 H12 Cl2 N2 O2 S -","- C22 H12 Cl2 N2 O2 S -","- C88 H48 Cl8 N8 O8 S4 -","4","0.5","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0244","0.0238","","","0.0619","0.0622","","","","","","1.076","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002919","7.1881","0.0003","20.1241","0.001","12.6012","0.0006","90","","98.493","0.004","90","","1802.83","0.15","300.3","0.4","300.3","0.4","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 Br2 N3 O2 -","- C16 H20 Br2 N3 O2 -","- C64 H80 Br8 N12 O8 -","4","1","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0597","0.0434","","","0.1062","0.1119","","","","","","1.067","","","","has coordinates","223182","2020-10-21","18:00:00",""
"4002920","11.936","0.003","6.0077","0.0013","9.478","0.002","90","","98.128","0.009","90","","672.8","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 Br O2 Pb -","- C4 H5 Br O2 Pb -","- C16 H20 Br4 O8 Pb4 -","4","1","","Yin, Jinlin; Yang, Huimin; Fei, Honghan","Robust, Cationic Lead Halide Layered Materials with Efficient Broadband White-Light Emission","Chemistry of Materials","2019","31","11","3909","","10.1021/acs.chemmater.8b05345","","","0.71073","MoKα","","0.078","0.0497","","","0.1251","0.1431","","","","","","1.051","","","","has coordinates","223186","2020-10-21","18:00:00",""
"4002921","9.843","0.003","9.024","0.003","6.66","0.002","90","","97.098","0.01","90","","587","0.3","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2.667 H3.333 Cl0.667 O1.333 Pb0.667 -","- C2.66667 H3.33333 Cl0.666667 O1.33333 Pb0.666667 -","- C16 H20 Cl4 O8 Pb4 -","6","1.5","","Yin, Jinlin; Yang, Huimin; Fei, Honghan","Robust, Cationic Lead Halide Layered Materials with Efficient Broadband White-Light Emission","Chemistry of Materials","2019","31","11","3909","","10.1021/acs.chemmater.8b05345","","","0.71073","MoKα","","0.0647","0.047","","","","0.1033","","","","","","1.1043","","","","has coordinates","223186","2020-10-21","18:00:00",""
"4002922","7.3957","0.0003","7.3957","0.0003","7.5452","0.0003","90","","90","","120","","357.4","0.02","296","","296","","","","","","","","","3","P 63/m","-P 6c","176","","","","- F2.667 Fe O0.55 -","- F2.66666 Fe O0.54874 -","- F16 Fe6 O3.29244 -","6","0.5","","Lemoine, Kévin; Zhang, Leiting; Dambournet, Damien; Grenèche, Jean-Marc; Hémon-Ribaud, Annie; Leblanc, Marc; Borkiewicz, Olaf J.; Tarascon, Jean-Marie; Maisonneuve, Vincent; Lhoste, Jérôme","Synthesis by Thermal Decomposition of Two Iron Hydroxyfluorides: Structural Effects of Li Insertion","Chemistry of Materials","2019","31","11","4246","","10.1021/acs.chemmater.9b01252","powder diffraction","","1.78901","CoKα","","","","","","","","","6.8247","1.8818","","","","","","","has coordinates","223187","2020-10-21","18:00:00",""
"4002923","10.3562","0.0004","10.3562","0.0004","10.3562","0.0004","90","","90","","90","","1110.71","0.07","296","","296","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- F2.5 Fe O -","- F2.50005 Fe O1.00007 -","- F40.0008 Fe16 O16.0011 -","16","0.0833333","","Lemoine, Kévin; Zhang, Leiting; Dambournet, Damien; Grenèche, Jean-Marc; Hémon-Ribaud, Annie; Leblanc, Marc; Borkiewicz, Olaf J.; Tarascon, Jean-Marie; Maisonneuve, Vincent; Lhoste, Jérôme","Synthesis by Thermal Decomposition of Two Iron Hydroxyfluorides: Structural Effects of Li Insertion","Chemistry of Materials","2019","31","11","4246","","10.1021/acs.chemmater.9b01252","powder diffraction","","1.78901","CoKα","","","","","","","","","6.3912","3.6021","","","","","","","has coordinates","223187","2020-10-21","18:00:00",""
"4002942","17.9067","0.0014","17.605","0.0014","5.7065","0.0005","90","","90.212","0.002","90","","1798.9","0.3","175","5","175","5","","","","","","","","2","C 1 2/m 1","-C 2y","12","molybdenum pentachloride","","","- Cl5 Mo -","- Cl5 Mo -","- Cl60 Mo12 -","12","1.5","","McGuire, Michael A.; Pandey, Tribhuwan; Mu, Sai; Parker, David S.","Ferromagnetic Spin-1/2 Dimers with Strong Anisotropy in MoCl5","Chemistry of Materials","2019","31","8","2952","","10.1021/acs.chemmater.9b00416","","","0.71073","MoKα","","0.0511","0.0402","","","0.0907","0.0965","","","","","","0.995","","","","has coordinates","220367","2020-10-21","18:00:00",""
"4002943","6.0628","0.0007","16.667","0.002","6.4569","0.0008","90","","115.502","0.002","90","","588.89","0.12","175","5","175","5","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","molybdenum pentachloride","","","- Cl5 Mo -","- Cl5 Mo -","- Cl20 Mo4 -","4","1","","McGuire, Michael A.; Pandey, Tribhuwan; Mu, Sai; Parker, David S.","Ferromagnetic Spin-1/2 Dimers with Strong Anisotropy in MoCl5","Chemistry of Materials","2019","31","8","2952","","10.1021/acs.chemmater.9b00416","","","0.71073","MoKα","","0.0507","0.0498","","","0.1215","0.122","","","","","","1.129","","","","has coordinates","220367","2020-10-21","18:00:00",""
"4002944","7.789","0.004","10.221","0.006","7.344","0.004","90","","90","","90","","584.7","0.6","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- H4 I Mo N O6 -","- H4 I Mo N O6 -","- H16 I4 Mo4 N4 O24 -","4","1","","Li, Yahui; Han, Guopeng; Yu, Hongwei; Li, Hao; Yang, Zhihua; Pan, Shilie","Two Polar Molybdenum(VI) Iodates(V) with Large Second-Harmonic Generation Responses","Chemistry of Materials","2019","31","8","2992","","10.1021/acs.chemmater.9b00521","","","0.71073","MoKα","","0.0292","0.0275","","","0.0592","0.06","","","","","","1.063","","","","has coordinates","220368","2020-10-21","18:00:00",""
"4002945","30.02","0.04","10.205","0.013","7.762","0.01","90","","103.786","0.015","90","","2309","5","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- I2 K Mo2 O12 Rb -","- I2 K1.0495 Mo2 O12 Rb0.9505 -","- I16 K8.396 Mo16 O96 Rb7.604 -","8","2","","Li, Yahui; Han, Guopeng; Yu, Hongwei; Li, Hao; Yang, Zhihua; Pan, Shilie","Two Polar Molybdenum(VI) Iodates(V) with Large Second-Harmonic Generation Responses","Chemistry of Materials","2019","31","8","2992","","10.1021/acs.chemmater.9b00521","","","0.71073","MoKα","","0.0632","0.0534","","","0.1125","0.1195","","","","","","1.049","","","","has coordinates","220369","2020-10-21","18:00:00",""
"4002946","7.82","0.0006","7.8238","0.0006","7.8325","0.0003","90","","90","","90","","479.21","0.06","573","","573","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Na Nb0.9 O2.95 Ti0.1 -","- Na Nb0.9 O2.95 Ti0.1 -","- Na8 Nb7.2 O23.6 Ti0.8 -","8","0.5","","Gouget, Guillaume; Duttine, Mathieu; Chung, U-Chan; Fourcade, Sébastien; Mauvy, Fabrice; Braida, Marc-David; Le Mercier, Thierry; Demourgues, Alain","High Ionic Conductivity in Oxygen-Deficient Ti-Substituted Sodium Niobates and the Key Role of Structural Features","Chemistry of Materials","2019","31","8","2828","","10.1021/acs.chemmater.8b05292","powder diffraction","x-ray","1.79028","","","0.0231","0.0185","","0.0283","0.0274","","","","1.85","","","","","","","has coordinates","220370","2020-10-21","18:00:00",""
"4002947","5.5495","0.0003","7.7714","0.0004","5.5088","0.0003","90","","90","","90","","237.58","0.02","293","","293","","","","","","","","","4","P 21 m a","P -2a 2a","26","","","","- Na Nb0.9 O2.95 Ti0.1 -","- Na Nb0.9 O2.95005 Ti0.1 -","- Na4 Nb3.6 O11.8002 Ti0.4 -","4","1","","Gouget, Guillaume; Duttine, Mathieu; Chung, U-Chan; Fourcade, Sébastien; Mauvy, Fabrice; Braida, Marc-David; Le Mercier, Thierry; Demourgues, Alain","High Ionic Conductivity in Oxygen-Deficient Ti-Substituted Sodium Niobates and the Key Role of Structural Features","Chemistry of Materials","2019","31","8","2828","","10.1021/acs.chemmater.8b05292","powder diffraction","x-ray","1.54187","","","0.0418","0.0355","","0.0536","0.051","","","","3.03","","","","","","","has coordinates","220371","2020-10-21","18:00:00",""
"4002948","3.94456","0.00005","3.94456","0.00005","3.94456","0.00005","90","","90","","90","","61.3756","0.0013","993","","993","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Na Nb0.9 O2.95 Ti0.1 -","- Na Nb0.9 O2.9499 Ti0.1 -","- Na Nb0.9 O2.9499 Ti0.1 -","1","0.0208333","","Gouget, Guillaume; Duttine, Mathieu; Chung, U-Chan; Fourcade, Sébastien; Mauvy, Fabrice; Braida, Marc-David; Le Mercier, Thierry; Demourgues, Alain","High Ionic Conductivity in Oxygen-Deficient Ti-Substituted Sodium Niobates and the Key Role of Structural Features","Chemistry of Materials","2019","31","8","2828","","10.1021/acs.chemmater.8b05292","powder diffraction","x-ray","1.79028","","","0.0239","0.0239","","0.0471","0.0471","","","","1.63","","","","","","","has coordinates","220372","2020-10-21","18:00:00",""
"4002949","7.8393","0.0003","7.8455","0.0004","7.8495","0.0003","90","","90","","90","","482.77","0.04","693","","693","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Na Nb0.9 O2.95 Ti0.1 -","- Na Nb0.9 O2.95 Ti0.1 -","- Na8 Nb7.2 O23.6 Ti0.8 -","8","0.5","","Gouget, Guillaume; Duttine, Mathieu; Chung, U-Chan; Fourcade, Sébastien; Mauvy, Fabrice; Braida, Marc-David; Le Mercier, Thierry; Demourgues, Alain","High Ionic Conductivity in Oxygen-Deficient Ti-Substituted Sodium Niobates and the Key Role of Structural Features","Chemistry of Materials","2019","31","8","2828","","10.1021/acs.chemmater.8b05292","powder diffraction","x-ray","1.79028","","","0.0296","0.0162","","0.0315","0.0277","","","","1.71","","","","","","","has coordinates","220373","2020-10-21","18:00:00",""
"4002950","5.5342","0.0003","7.7926","0.0003","5.5182","0.0003","90","","90","","90","","237.98","0.02","373","","373","","","","","","","","","4","P 21 m a","P -2a 2a","26","","","","- Na Nb0.9 O2.95 Ti0.1 -","- Na Nb0.9 O2.95005 Ti0.1 -","- Na4 Nb3.6 O11.8002 Ti0.4 -","4","1","","Gouget, Guillaume; Duttine, Mathieu; Chung, U-Chan; Fourcade, Sébastien; Mauvy, Fabrice; Braida, Marc-David; Le Mercier, Thierry; Demourgues, Alain","High Ionic Conductivity in Oxygen-Deficient Ti-Substituted Sodium Niobates and the Key Role of Structural Features","Chemistry of Materials","2019","31","8","2828","","10.1021/acs.chemmater.8b05292","powder diffraction","x-ray","1.79028","","","0.0298","0.0223","","0.0386","0.0367","","","","2.35","","","","","","","has coordinates","220374","2020-10-21","18:00:00",""
"4002951","10.8375","0.0007","10.7456","0.0006","6.6377","0.0004","90","","90","","90","","773","0.08","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- Ge Hg Se4 Sr -","- Ge Hg Se4 Sr -","- Ge4 Hg4 Se16 Sr4 -","4","0.5","","Guo, Yangwu; Liang, Fei; Yin, Wenlong; Li, Zhuang; Luo, Xiaoyu; Lin, Zhe-Shuai; Yao, Jiyong; Mar, Arthur; Wu, Yicheng","BaHgGeSe4 and SrHgGeSe4: Two New Hg-Based Infrared Nonlinear Optical Materials","Chemistry of Materials","2019","31","8","3034","","10.1021/acs.chemmater.9b01023","","","0.71073","MoKα","","0.0456","0.0451","","","0.1113","0.1116","","","","","","1.131","","","","has coordinates","220375","2020-10-21","18:00:00",""
"4002952","11.255","0.002","11.033","0.002","6.6847","0.0013","90","","90","","90","","830.1","0.3","153","2","153","2","","","","","","","","4","A m a 2","A 2 -2a","40","","","","- Ba Ge Hg Se4 -","- Ba Ge Hg Se4 -","- Ba4 Ge4 Hg4 Se16 -","4","0.5","","Guo, Yangwu; Liang, Fei; Yin, Wenlong; Li, Zhuang; Luo, Xiaoyu; Lin, Zhe-Shuai; Yao, Jiyong; Mar, Arthur; Wu, Yicheng","BaHgGeSe4 and SrHgGeSe4: Two New Hg-Based Infrared Nonlinear Optical Materials","Chemistry of Materials","2019","31","8","3034","","10.1021/acs.chemmater.9b01023","","","0.71073","MoKα","","0.0441","0.0393","","","0.0955","0.0967","","","","","","1.116","","","","has coordinates","220376","2020-10-21","18:00:00",""
"4002953","7.2941","0.0005","15.3229","0.001","15.3893","0.001","90","","90","","90","","1720","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 Br4 N4 Zn -","- C10 H14 Br4 N4 Zn -","- C40 H56 Br16 N16 Zn4 -","4","1","","Yangui, Aymen; Roccanova, Rachel; McWhorter, Timothy M.; Wu, Yuntao; Du, Mao-Hua; Saparov, Bayrammurad","Hybrid Organic‒Inorganic Halides (C5H7N2)2MBr4 (M = Hg, Zn) with High Color Rendering Index and High-Efficiency White-Light Emission","Chemistry of Materials","2019","31","8","2983","","10.1021/acs.chemmater.9b00537","","","0.71073","MoKα","","0.018","0.0163","","","0.0344","0.0348","","","","","","1.008","","","","has coordinates","220377","2020-10-21","18:00:00",""
"4002954","6.7934","0.0007","13.8808","0.0015","18.685","0.002","90","","90","","90","","1762","0.3","100","2","100","2","","","","","","","","6","P b c m","-P 2c 2b","57","DD115","di(4-aminopyridine)tetrabromomercurate","","- C10 H16 Br4 Hg N4 O -","- C10 H16 Br4 Hg N4 O -","- C40 H64 Br16 Hg4 N16 O4 -","4","0.5","","Yangui, Aymen; Roccanova, Rachel; McWhorter, Timothy M.; Wu, Yuntao; Du, Mao-Hua; Saparov, Bayrammurad","Hybrid Organic‒Inorganic Halides (C5H7N2)2MBr4 (M = Hg, Zn) with High Color Rendering Index and High-Efficiency White-Light Emission","Chemistry of Materials","2019","31","8","2983","","10.1021/acs.chemmater.9b00537","","","0.71073","MoKα","","0.0238","0.0172","","","0.0322","0.0338","","","","","","1.01","","","","has coordinates","220378","2020-10-21","18:00:00",""
"4002955","15.214","0.004","6.5316","0.0018","11.33","0.003","90","","96.646","0.004","90","","1118.3","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","","Nakamura, Tomoya; Shioya, Nobutaka; Shimoaka, Takafumi; Nishikubo, Ryosuke; Hasegawa, Takeshi; Saeki, Akinori; Murata, Yasujiro; Murdey, Richard; Wakamiya, Atsushi","Molecular Orientation Change in Naphthalene Diimide Thin Films Induced by Removal of Thermally Cleavable Substituents","Chemistry of Materials","2019","31","5","1729","","10.1021/acs.chemmater.8b05237","","","0.71073","MoKα","","0.0747","0.0427","","","0.1158","0.1478","","","","","","1.129","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002956","5.0627","0.0005","10.0139","0.0011","16.3981","0.0017","89.874","0.004","85.867","0.003","80.53","0.004","817.84","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Celecixib","4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide","","- C17 H14 F3 N3 O2 S -","- C17 H14 F3 N3 O2 S -","- C34 H28 F6 N6 O4 S2 -","2","1","","Wang, Kunlin; Mishra, Manish Kumar; Sun, Changquan Calvin","Exceptionally Elastic Single-Component Pharmaceutical Crystals","Chemistry of Materials","2019","31","5","1794","","10.1021/acs.chemmater.9b00040","","","0.71073","MoKα","","0.0588","0.0409","","","0.0834","0.0911","","","","","","1.1","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002957","10.8429","0.00006","10.8429","0.00006","10.8429","0.00006","90","","90","","90","","1274.78","0.012","298","","298","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","?Cs2NaBiCl6?","- Bi Cl6 Cs2 Na -","- Bi Cl6 Cs2 Na -","- Bi4 Cl24 Cs8 Na4 -","4","0.0208333","","Majher, Jackson D.; Gray, Matthew B.; Strom, T. Amanda; Woodward, Patrick M.","Cs2NaBiCl6:Mn2+—A New Orange-Red Halide Double Perovskite Phosphor","Chemistry of Materials","2019","31","5","1738","","10.1021/acs.chemmater.8b05280","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","286259","2023-09-07","05:55:36",""
"4002958","5.5751","0.0004","25.0978","0.0018","12.0481","0.0008","90","","91.294","0.003","90","","1685.4","0.2","100","","100","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 -","- C23 H24 -","- C92 H96 -","4","1","","Abdulhamid, Mahmoud A.; Lai, Holden W. H.; Wang, Yingge; Jin, Zexin; Teo, Yew Chin; Ma, Xiaohua; Pinnau, Ingo; Xia, Yan","Microporous Polyimides from Ladder Diamines Synthesized by Facile Catalytic Arene–Norbornene Annulation as High-Performance Membranes for Gas Separation","Chemistry of Materials","2019","31","5","1767","","10.1021/acs.chemmater.8b05359","","x-ray","0.7749","","","0.0533","0.0468","","","0.1236","0.1289","","","","","","1.045","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002959","13.348","0.003","7.9703","0.0016","6.1343","0.0012","90","","90","","90","","652.6","0.2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","Lithium thio-phosphate thio-silicate","","","- Li7 P S8 Si -","- Li7 P S8 Si -","- Li14 P2 S16 Si2 -","2","0.25","","Harm, Sascha; Hatz, Anna-Katharina; Moudrakovski, Igor; Eger, Roland; Kuhn, Alexander; Hoch, Constantin; Lotsch, Bettina V.","Lesson Learned from NMR: Characterization and Ionic Conductivity of LGPS-like Li7SiPS8","Chemistry of Materials","2019","31","4","1280","","10.1021/acs.chemmater.8b04051","","","0.71073","MoKα","","0.0383","0.0237","","","0.0484","0.0524","","","","","","0.883","","","","has coordinates","220383","2020-10-21","18:00:00",""
"4002960","12.8917","0.0006","15.4364","0.0007","18.9628","0.0008","90","","90.9808","0.0018","90","","3773.1","0.3","120","2","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C49 H38 Cl2 N4 -","- C49 H38 Cl2 N4 -","- C196 H152 Cl8 N16 -","4","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C–C Bonded Donor–Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","0.71073","MoKα","","0.0655","0.0475","","","0.1181","0.1289","","","","","","1.022","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002961","23.7795","0.0007","31.6796","0.0009","28.2823","0.0008","90","","105.925","0.0014","90","","20488.1","1","120","2","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C87 H54 F9 N7 -","- C86.75 H53.2 F9 N6.78333 -","- C1041 H638.4 F108 N81.4 -","12","3","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C‒C Bonded Donor‒Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","","1.54184","CuKα","","0.2054","0.0875","","","0.1951","0.2584","","","","","","0.963","","","","has coordinates,has disorder","220385","2020-10-21","18:00:00",""
"4002962","11.597","0.0006","11.7168","0.0007","30.9436","0.0017","90","","94.632","0.004","90","","4190.9","0.4","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C51 H33 F9 N4 -","- C51 H33 F9 N4 -","- C204 H132 F36 N16 -","4","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C–C Bonded Donor–Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","1.54184","CuKα","","0.0845","0.053","","","0.1237","0.1404","","","","","","1.017","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002963","13.5152","0.0009","15.9168","0.0011","16.6423","0.0011","85.84","0.003","81.097","0.003","87.662","0.003","3526","0.4","120","2","120","","","","","","","","","4","P -1","-P 1","2","","","","- C85 H53 Cl8 N7 -","- C84.75 H52.5 Cl8 N7 -","- C169.5 H105 Cl16 N14 -","2","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C‒C Bonded Donor‒Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","0.71073","MoKα","","0.0777","0.0503","","","0.118","0.1297","","","","","","1.043","","","","has coordinates,has disorder","220387","2020-10-21","18:00:00",""
"4002964","8.8469","0.0004","14.7416","0.0007","17.2028","0.0008","78.926","0.0016","75.5208","0.0016","78.6689","0.0016","2105.66","0.17","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C48 H30 F18 N4 -","- C48 H30 F18 N4 -","- C96 H60 F36 N8 -","2","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C–C Bonded Donor–Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","0.71073","MoKα","","0.0515","0.0359","","","0.0858","0.0922","","","","","","1.024","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002965","12.6152","0.001","13.4441","0.0011","17.6978","0.0014","103.975","0.003","108.229","0.003","99.666","0.003","2668.3","0.4","120","","120","","","","","","","","","3","P -1","-P 1","2","","","","- C78 H48 N4 -","- C78 H48 N4 -","- C156 H96 N8 -","2","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C–C Bonded Donor–Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","0.71073","MoKα","","0.0785","0.05","","","0.128","0.1404","","","","","","1.041","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002966","13.2691","0.0005","17.2803","0.0007","17.4319","0.0006","83.5287","0.0015","71.3655","0.0014","75.6091","0.0014","3666.2","0.2","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C80.5 H59 Cl11 N4 -","- C81 H54 Cl6 N4 -","- C162 H108 Cl12 N8 -","2","1","","Ward, Jonathan S.; Kukhta, Nadzeya A.; dos Santos, Paloma L.; Congrave, Daniel G.; Batsanov, Andrei S.; Monkman, Andrew P.; Bryce, Martin R.","Delayed Blue Fluorescence via Upper-Triplet State Crossing from C‒C Bonded Donor‒Acceptor Charge Transfer Molecules with Azatriangulene Cores","Chemistry of Materials","2019","31","17","6684","","10.1021/acs.chemmater.9b01184","","x-ray","0.71073","MoKα","","0.0802","0.0637","","","0.1633","0.1742","","","","","","1.058","","","","has coordinates,has disorder","220390","2020-10-21","18:00:00",""
"4002967","8.0302","0.0002","42.395","0.0009","9.439","0.0002","90","","97.458","0.002","90","","3186.23","0.13","100","0.1","100","0.1","","","","","","","","5","I 1 a 1","I -2ya","9","","","","- C32 H24 I3 N5 Pb -","- C32 H24 I3 N5 Pb -","- C128 H96 I12 N20 Pb4 -","4","1","","Marchal, Nadège; Van Gompel, Wouter; Gélvez-Rueda, María C.; Vandewal, Koen; Van Hecke, Kristof; Boyen, Hans-Gerd; Conings, Bert; Herckens, Roald; Maheshwari, Sudeep; Lutsen, Laurence; Quarti, Claudio; Grozema, Ferdinand C.; Vanderzande, Dirk; Beljonne, David","Lead-Halide Perovskites Meet Donor‒Acceptor Charge-Transfer Complexes","Chemistry of Materials","2019","31","17","6880","","10.1021/acs.chemmater.9b01289","","x-ray","0.71073","MoKα","","0.0286","0.026","","","0.0541","0.0556","","","","","","1.041","","","","has coordinates","220391","2020-10-21","18:00:00",""
"4002968","8.60863","0.00016","14.2697","0.0003","5.32468","0.0001","90","","100.651","0.0007","90","","642.83","0.02","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Se4 -","- C12 H10 Se4 -","- C24 H20 Se8 -","2","0.5","","Takenaka, Hiroyuki; Ogaki, Takuya; Wang, Chengyuan; Kawabata, Kohsuke; Takimiya, Kazuo","Selenium-Substituted β-Methylthiobenzo[1,2-b:4,5-b′]dithiophenes: Synthesis, Packing Structure, and Transport Properties","Chemistry of Materials","2019","31","17","6696","","10.1021/acs.chemmater.9b01187","","","1.54187","CuKα","","0.0347","0.0328","","","0.0767","0.0779","","","","","","1.097","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002969","14.5203","0.0004","5.27442","0.00015","15.8554","0.0004","90","","90","","90","","1214.3","0.06","100","","100","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H10 S2 Se2 -","- C12 H10 S2 Se2 -","- C48 H40 S8 Se8 -","4","0.5","","Takenaka, Hiroyuki; Ogaki, Takuya; Wang, Chengyuan; Kawabata, Kohsuke; Takimiya, Kazuo","Selenium-Substituted β-Methylthiobenzo[1,2-b:4,5-b′]dithiophenes: Synthesis, Packing Structure, and Transport Properties","Chemistry of Materials","2019","31","17","6696","","10.1021/acs.chemmater.9b01187","","","1.54187","CuKα","","0.0692","0.0586","","","0.1527","0.1605","","","","","","1.032","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002970","5.32021","0.0001","7.28902","0.00017","8.31911","0.00019","81.0598","0.0015","80.9249","0.0015","71.7042","0.0013","300.53","0.012","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 S2 Se2 -","- C12 H10 S2 Se2 -","- C12 H10 S2 Se2 -","1","0.5","","Takenaka, Hiroyuki; Ogaki, Takuya; Wang, Chengyuan; Kawabata, Kohsuke; Takimiya, Kazuo","Selenium-Substituted β-Methylthiobenzo[1,2-b:4,5-b′]dithiophenes: Synthesis, Packing Structure, and Transport Properties","Chemistry of Materials","2019","31","17","6696","","10.1021/acs.chemmater.9b01187","","","1.54187","CuKα","","0.0607","0.0566","","","0.1393","0.1442","","","","","","1.076","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002971","8.4327","0.0002","13.6718","0.0003","5.46391","0.00014","90","","99.7583","0.0016","90","","620.82","0.03","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 Se4 -","- C12 H10 Se4 -","- C24 H20 Se8 -","2","0.5","","Takenaka, Hiroyuki; Ogaki, Takuya; Wang, Chengyuan; Kawabata, Kohsuke; Takimiya, Kazuo","Selenium-Substituted β-Methylthiobenzo[1,2-b:4,5-b′]dithiophenes: Synthesis, Packing Structure, and Transport Properties","Chemistry of Materials","2019","31","17","6696","","10.1021/acs.chemmater.9b01187","","","1.54187","CuKα","","0.0563","0.0504","","","0.1132","0.1162","","","","","","1.07","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002972","7.13182","0.00014","7.33176","0.00014","22.8392","0.0004","90","","90","","90","","1194.23","0.04","99.9","0.5","99.9","0.5","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","di(ortho-methylphenyl) selane","","- C14 H14 Se -","- C14 H14 Se -","- C56 H56 Se4 -","4","1","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0357","0.0354","","","0.0926","0.0928","","","","","","1.061","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002973","9.74881","0.00017","6.68747","0.00014","16.9645","0.0003","90","","90.755","0.0015","90","","1105.9","0.04","297.6","0.1","297.6","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,6-dimethyldibenzoselenophene","","- C14 H12 Se -","- C14 H12 Se -","- C56 H48 Se4 -","4","1","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0328","0.0299","","","0.0873","0.1114","","","","","","1.222","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002974","6.64274","0.00017","18.4437","0.0005","16.9726","0.0004","90","","90","","90","","2079.43","0.09","298.48","0.1","298.48","0.1","","","","","","","","6","C m c 21","C 2c -2","36","","2,3-dibromo-5,6-dicyanobenzioquinone 4,6-dimethyldibenzoselenophene","","- C22 H12 Br2 N2 O2 Se -","- C22 H12 Br2 N2 O2 Se -","- C88 H48 Br8 N8 O8 Se4 -","4","0.5","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0221","0.021","","","0.0547","0.0549","","","","","","1.074","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002975","6.6092","0.0001","18.3407","0.0002","16.8277","0.0001","90","","90","","90","","2039.81","0.04","293","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","2,3-dibromo-5,6-dicyanobenzoquinone 4,6-dimethyldibenzothiophene","","- C22 H12 Br2 N2 O2 S -","- C22 H12 Br2 N2 O2 S -","- C88 H48 Br8 N8 O8 S4 -","4","0.5","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0374","0.0349","","","0.0819","0.0899","","","","","","1.074","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4002976","6.6291","0.0005","9.706","0.0007","16.5873","0.0007","77.051","0.005","88.795","0.004","72.485","0.006","990.66","0.12","298.7","0.5","298.7","0.5","","","","","","","","6","P -1","-P 1","2","","4,6-dimethyldibenzoselenophene 2,3-dichloro-5,6-dicyanobenzoquinone","","- C22 H12 Cl2 N2 O2 Se -","- C22 H12 Cl2 N2 O2 Se -","- C44 H24 Cl4 N4 O4 Se2 -","2","1","","Wiscons, Ren A.; Coropceanu, Veaceslav; Matzger, Adam J.","Quaternary Charge-Transfer Solid Solutions: Electronic Tunability through Stoichiometry","Chemistry of Materials","2019","31","17","6598","","10.1021/acs.chemmater.9b00502","","x-ray","1.54184","CuKα","","0.0844","0.0755","","","0.2017","0.2098","","","","","","1.105","","","","has coordinates,has disorder","220400","2020-10-21","18:00:00",""
"4002977","14.7769","0.0007","14.7769","0.0007","13.6748","0.0009","90","","90","","120","","2585.9","0.2","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C6 H24 Bi2 I10 N4 O2 -","- C6 H24 Bi2 I10 N4 O2 -","- C18 H72 Bi6 I30 N12 O6 -","3","0.5","","Pious, Johnpaul K.; Katre, Ankita; Muthu, Chinnadurai; Chakraborty, Sudip; Krishna, Swathi; Nair, Vijayakumar C.","Zero-Dimensional Lead-Free Hybrid Perovskite-like Material with a Quantum-Well Structure","Chemistry of Materials","2019","31","6","1941","","10.1021/acs.chemmater.8b04642","","","0.71073","MoKα","","0.0444","0.0319","","","0.065","0.0704","","","","","","1.043","","","","has coordinates","220401","2020-10-21","18:00:00",""
"4002978","5.9997","0.0008","5.9997","0.0008","5.9997","0.0008","90","","90","","90","","215.97","0.05","296","2","296","2","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Ga2 Li Rh -","- Ga2 Li Rh -","- Ga8 Li4 Rh4 -","4","0.0208333","","Carnicom, Elizabeth M.; Xie, Weiwei; Yang, Zoe; Górnicka, Karolina; Kong, Tai; Klimczuk, Tomasz; Cava, Robert J.","Importance of Specific Heat Characterization when Reporting New Superconductors: An Example of Superconductivity in LiGa2Rh","Chemistry of Materials","2019","31","6","2164","","10.1021/acs.chemmater.9b00258","","","0.71073","MoKα","","0.0185","0.0185","","","0.051","0.051","","","","","","1.416","","","","has coordinates","220402","2020-10-21","18:00:00",""
"4002979","9.344","0.0016","9.344","0.0016","14.498","0.004","90","","90","","120","","1096.2","0.4","293","2","293","2","","","","","","","","8","P 63","P 6c","173","","","","- C3 H0 Br Cs0 Lu8 N0 O25 Zn0 -","- C3 Br Lu8 O25 -","- C6 Br2 Lu16 O50 -","2","0.333333","","Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning","Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials","Chemistry of Materials","2019","31","6","2130","","10.1021/acs.chemmater.9b00068","","","0.71073","MoKα","","0.0672","0.0522","","","0.1098","0.1519","","","","","","1.062","","","","has coordinates","220403","2020-10-21","18:00:00",""
"4002980","9.4927","0.0009","9.4927","0.0009","14.752","0.003","90","","90","","120","","1151.2","0.3","293","2","293","2","","","","","","","","8","P 63","P 6c","173","","","","- C3 H0 Br Cs0 N0 O25 Y8 Zn0 -","- C3 Br O25 Y8 -","- C6 Br2 O50 Y16 -","2","0.333333","","Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning","Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials","Chemistry of Materials","2019","31","6","2130","","10.1021/acs.chemmater.9b00068","","","0.71073","MoKα","","0.06","0.0502","","","0.1014","0.1053","","","","","","0.981","","","","has coordinates","220404","2020-10-21","18:00:00",""
"4002981","9.354","0.0016","9.354","0.0016","14.415","0.003","90","","90","","120","","1092.3","0.3","293","2","293","2","","","","","","","","4","P 63","P 6c","173","","","","- C3 Cl Lu8 O25 -","- C3 Cl Lu8 O25 -","- C6 Cl2 Lu16 O50 -","2","0.333333","","Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning","Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials","Chemistry of Materials","2019","31","6","2130","","10.1021/acs.chemmater.9b00068","","","0.71073","MoKα","","0.0381","0.0367","","","0.0759","0.0766","","","","","","1.142","","","","has coordinates","220405","2020-10-21","18:00:00",""
"4002982","9.5353","0.0012","9.5353","0.0012","14.729","0.005","90","","90","","120","","1159.8","0.4","296","2","296","2","","","","","","","","5","P 63","P 6c","173","","","","- C3 H15 Cl O25 Y8 -","- C3 H15 Cl O25 Y8 -","- C6 H30 Cl2 O50 Y16 -","2","0.333333","","Cao, Liling; Song, Yunxia; Peng, Guang; Luo, Min; Yang, Yi; Lin, Chen-sheng; Zhao, Dan; Xu, Feng; Lin, Zheshuai; Ye, Ning","Refractive Index Modulates Second-Harmonic Responses in RE8O(CO3)3(OH)15X (RE = Y, Lu; X = Cl, Br): Rare-Earth Halide Carbonates as Ultraviolet Nonlinear Optical Materials","Chemistry of Materials","2019","31","6","2130","","10.1021/acs.chemmater.9b00068","","","0.71073","MoKα","","0.0622","0.0532","","","0.0978","0.1015","","","","","","1.183","","","","has coordinates","220406","2020-10-21","18:00:00",""
"4002983","32.082","0.003","8.3226","0.0006","10.4238","0.0008","90","","90","","90","","2783.2","0.4","298","","298","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C2 H12 Br4 N6 Sn -","- C2 H12 Br4 N6 Sn -","- C16 H96 Br32 N48 Sn8 -","8","2","","Nazarenko, Olga; Kotyrba, Martin R.; Yakunin, Sergii; Wörle, Michael; Benin, Bogdan M.; Rainò, Gabriele; Krumeich, Frank; Kepenekian, Mikaël; Even, Jacky; Katan, Claudine; Kovalenko, Maksym V.","Guanidinium and Mixed Cesium-Guanidinium Tin(II) Bromides: Effects of Quantum Confinement and Out-of-Plane Octahedral Tilting.","Chemistry of materials : a publication of the American Chemical Society","2019","31","6","2121","2129","10.1021/acs.chemmater.9b00038","","x-ray","0.71073","MoKα","","0.0574","0.0348","","","0.0674","0.0738","","","","","","1.013","","","","has coordinates","220407","2020-10-21","18:00:00",""
"4002984","6.0112","0.001","11.5363","0.0018","17.342","0.003","90","","90","","90","","1202.6","0.3","250","","250","","","","","","","","","6","I m m a","-I 2b 2","74","","","","- C H6 Br4 Cs N3 Sn -","- C H6 Br4 Cs N3 Sn -","- C4 H24 Br16 Cs4 N12 Sn4 -","4","0.25","","Nazarenko, Olga; Kotyrba, Martin R.; Yakunin, Sergii; Wörle, Michael; Benin, Bogdan M.; Rainò, Gabriele; Krumeich, Frank; Kepenekian, Mikaël; Even, Jacky; Katan, Claudine; Kovalenko, Maksym V.","Guanidinium and Mixed Cesium-Guanidinium Tin(II) Bromides: Effects of Quantum Confinement and Out-of-Plane Octahedral Tilting.","Chemistry of materials : a publication of the American Chemical Society","2019","31","6","2121","2129","10.1021/acs.chemmater.9b00038","","","0.71073","MoKα","","0.0279","0.0227","","","0.0512","0.053","","","","","","1.032","","","","has coordinates","220408","2020-10-21","18:00:00",""
"4002985","16.93","0.003","17.029","0.003","16.693","0.003","90","","92.61","0.03","90","","4807.6","1.5","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Mn4 Sb18 Yb21 -","- Mn3.923 Sb18 Yb20.9416 -","- Mn15.692 Sb72 Yb83.7664 -","4","0.5","","He, Allan; Bux, Sabah K.; Hu, Yufei; Uhl, David; Li, Li; Donadio, Davide; Kauzlarich, Susan M.","Structural Complexity and High Thermoelectric Performance of the Zintl Phase: Yb21Mn4Sb18","Chemistry of Materials","2019","31","19","8076","","10.1021/acs.chemmater.9b02671","","","0.71073","MoKα","","0.0284","0.0224","","","0.0394","0.0411","","","","","","1.142","","","","has coordinates,has disorder","220409","2020-10-21","18:00:00",""
"4002986","15.8869","0.0013","18.505","0.003","27.6655","0.0015","90","","102.617","0.007","90","","7936.9","1.5","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C94 H80 Br2 N4 O2 S4 -","- C94 H80 Br2 N4 O2 S4 -","- C376 H320 Br8 N16 O8 S16 -","4","1","","Qu, Jianfei; Li, Duning; Wang, Huan; Zhou, Jiadong; Zheng, Nan; Lai, Hanjian; Liu, Tao; Xie, Zengqi; He, Feng","Bromination of the Small-Molecule Acceptor with Fixed Position for High-Performance Solar Cells","Chemistry of Materials","2019","31","19","8044","","10.1021/acs.chemmater.9b02501","","x-ray","1.54184","CuKα","","0.2461","0.131","","","0.3258","0.4238","","","","","","1.252","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4002987","13.0467","0.0018","8.0707","0.0012","6.1395","0.0009","90","","90","","90","","646.46","0.16","280","2","280","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.21 P0.85 S4 Si0.15 -","- Li3.216 P0.85 S4 Si0.15 -","- Li12.864 P3.4 S16 Si0.6 -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0506","0.0355","","","0.0726","0.0754","","","","","","1.213","","","","has coordinates","220411","2020-10-21","18:00:00",""
"4002988","13.4165","0.0019","7.9107","0.0011","6.1283","0.0008","90","","90","","90","","650.42","0.15","280","2","280","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.58 P0.5 S4 Si0.5 -","- Li3.57 P0.5 S4 Si0.5 -","- Li14.28 P2 S16 Si2 -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0543","0.0373","","","0.0893","0.0995","","","","","","1.005","","","","has coordinates","220412","2020-10-21","18:00:00",""
"4002989","6.112","0.002","7.781","0.003","6.88","0.003","90","","91.147","0.009","90","","327.1","0.2","280","2","280","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Li3.83 P0.2 S4 Si0.8 -","- Li3.82 P0.2 S4 Si0.8 -","- Li7.64 P0.4 S8 Si1.6 -","2","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.065","0.048","","","0.1146","0.1216","","","","","","1.117","","","","has coordinates","220413","2020-10-21","18:00:00",""
"4002990","13.675","0.0018","7.7946","0.001","6.1411","0.0009","90","","90","","90","","654.59","0.15","280","2","280","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.66 P0.33 S4 Si0.67 -","- Li3.65 P0.33 S4 Si0.67 -","- Li14.6 P1.32 S16 Si2.68 -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0472","0.0441","","","0.1158","0.1185","","","","","","1.099","","","","has coordinates","220414","2020-10-21","18:00:00",""
"4002991","13.158","0.0012","8.0286","0.0007","6.1287","0.0005","90","","90","","90","","647.44","0.1","280","2","280","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.28 P0.75 S4 Si0.25 -","- Li3.274 P0.75 S4 Si0.25 -","- Li13.096 P3 S16 Si -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0263","0.0192","","","0.0438","0.0461","","","","","","1.036","","","","has coordinates","220415","2020-10-21","18:00:00",""
"4002992","13.156","0.007","8.016","0.004","6.132","0.003","90","","90","","90","","646.7","0.6","180","2","180","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.23 P0.75 S4 Si0.25 -","- Li3.224 P0.75 S4 Si0.25 -","- Li12.896 P3 S16 Si -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0458","0.0311","","","0.0686","0.0737","","","","","","0.984","","","","has coordinates","220416","2020-10-21","18:00:00",""
"4002993","13.2489","0.0004","8.0094","0.0002","6.1311","0.0002","90","","90","","90","","650.61","0.03","280","2","280","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Li3.33 P0.67 S4 Si0.33 -","- Li3.324 P0.67 S4 Si0.33 -","- Li13.296 P2.68 S16 Si1.32 -","4","0.5","","Zhou, Laidong; Assoud, Abdeljalil; Shyamsunder, Abhinandan; Huq, Ashfia; Zhang, Qiang; Hartmann, Pascal; Kulisch, Joern; Nazar, Linda F.","An Entropically Stabilized Fast-Ion Conductor: Li3.25[Si0.25P0.75]S4","Chemistry of Materials","2019","31","19","7801","","10.1021/acs.chemmater.9b00657","","","0.71073","MoKα","","0.0142","0.013","","","0.0358","0.0368","","","","","","0.838","","","","has coordinates","220417","2020-10-21","18:00:00",""
"4002994","8.63101","0.00011","8.95452","0.0001","15.8648","0.0002","90","","95.9401","0.0013","90","","1219.55","0.03","225","0.1","225","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H18 Cl2 I4 N2 Pb -","- C14 H18 Cl2 I4 N2 Pb -","- C28 H36 Cl4 I8 N4 Pb2 -","2","1","","Tremblay, Marie-Hélène; Bacsa, John; Zhao, Boqin; Pulvirenti, Federico; Barlow, Stephen; Marder, Seth R.","Structures of (4-Y-C6H4CH2NH3)2PbI4 {Y = H, F, Cl, Br, I}: Tuning of Hybrid Organic Inorganic Perovskite Structures from Ruddlesden‒Popper to Dion‒Jacobson Limits","Chemistry of Materials","2019","31","16","6145","","10.1021/acs.chemmater.9b01564","","x-ray","0.71073","MoKα","","0.0538","0.0396","","","0.0873","0.0919","","","","","","0.984","","","","has coordinates","220418","2020-10-21","18:00:00",""
"4002995","8.6061","0.0001","8.9116","0.0001","15.8703","0.0002","90","","95.141","0.001","90","","1212.26","0.02","104","0.8","104","0.8","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H18 Br2 I4 N2 Pb -","- C14 H18 Br2 I4 N2 Pb -","- C28 H36 Br4 I8 N4 Pb2 -","2","1","","Tremblay, Marie-Hélène; Bacsa, John; Zhao, Boqin; Pulvirenti, Federico; Barlow, Stephen; Marder, Seth R.","Structures of (4-Y-C6H4CH2NH3)2PbI4 {Y = H, F, Cl, Br, I}: Tuning of Hybrid Organic Inorganic Perovskite Structures from Ruddlesden‒Popper to Dion‒Jacobson Limits","Chemistry of Materials","2019","31","16","6145","","10.1021/acs.chemmater.9b01564","","x-ray","0.71073","MoKα","","0.0267","0.0242","","","0.0514","0.0519","","","","","","1.013","","","","has coordinates","220419","2020-10-21","18:00:00",""
"4002996","8.69555","0.00015","9.24417","0.00016","27.5255","0.0006","90","","97.6029","0.0019","90","","2193.13","0.07","106","6","106","6","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 F2 I4 N2 Pb -","- C14 H18 F2 I4 N2 Pb -","- C56 H72 F8 I16 N8 Pb4 -","4","1","","Tremblay, Marie-Hélène; Bacsa, John; Zhao, Boqin; Pulvirenti, Federico; Barlow, Stephen; Marder, Seth R.","Structures of (4-Y-C6H4CH2NH3)2PbI4 {Y = H, F, Cl, Br, I}: Tuning of Hybrid Organic Inorganic Perovskite Structures from Ruddlesden‒Popper to Dion‒Jacobson Limits","Chemistry of Materials","2019","31","16","6145","","10.1021/acs.chemmater.9b01564","","x-ray","0.71073","MoKα","","0.0413","0.0313","","","0.0602","0.0626","","","","","","1.065","","","","has coordinates","220420","2020-10-21","18:00:00",""
"4002997","16.9722","0.0002","8.8779","0.00012","8.67966","0.00011","90","","103.356","0.0014","90","","1272.46","0.03","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 I6 N2 Pb -","- C14 H18 I6 N2 Pb -","- C28 H36 I12 N4 Pb2 -","2","0.5","","Tremblay, Marie-Hélène; Bacsa, John; Zhao, Boqin; Pulvirenti, Federico; Barlow, Stephen; Marder, Seth R.","Structures of (4-Y-C6H4CH2NH3)2PbI4 {Y = H, F, Cl, Br, I}: Tuning of Hybrid Organic Inorganic Perovskite Structures from Ruddlesden‒Popper to Dion‒Jacobson Limits","Chemistry of Materials","2019","31","16","6145","","10.1021/acs.chemmater.9b01564","","x-ray","0.71073","MoKα","","0.0265","0.0237","","","0.0517","0.0526","","","","","","1.045","","","","has coordinates","220421","2020-10-21","18:00:00",""
"4002998","19.4841","0.0015","19.4841","0.0015","29.403","0.002","90","","90","","120","","9666.8","1.2","200","2","200","2","","","","","","","","6","R -3 :H","-R 3","148","Ni-MaSOF","","","- C64 H34 N6 Ni3 O6 S0.67 -","- C64 H34 N6 Ni3 O6 -","- C384 H204 N36 Ni18 O36 -","6","0.333333","","Elbert, Sven M.; Zhang, Wen-Shan; Vaynzof, Yana; Oberhof, Nils; Bernhardt, Moritz; Pernpointner, Markus; Rominger, Frank; Schröder, Rasmus R.; Mastalerz, Michael","Metal-Assisted Salphen Organic Frameworks (MaSOFs) with Trinuclear Metal Units for Synergic Gas Sorption","Chemistry of Materials","2019","31","16","6210","","10.1021/acs.chemmater.9b02165","","","0.71073","MoKα","","0.066","0.0448","","","0.108","0.1173","","","","","","1.031","","","","has coordinates","220422","2020-10-21","18:00:00",""
"4002999","19.647","0.004","19.647","0.004","29.805","0.006","90","","90","","120","","9964","4","200","2","200","2","","","","","","","","6","R -3 :H","-R 3","148","Cu-MaSOF","","","- C76 H70 Cu3 N6 O12 S6 -","- C76 H70 Cu3 N6 O12 S6 -","- C456 H420 Cu18 N36 O72 S36 -","6","0.333333","","Elbert, Sven M.; Zhang, Wen-Shan; Vaynzof, Yana; Oberhof, Nils; Bernhardt, Moritz; Pernpointner, Markus; Rominger, Frank; Schröder, Rasmus R.; Mastalerz, Michael","Metal-Assisted Salphen Organic Frameworks (MaSOFs) with Trinuclear Metal Units for Synergic Gas Sorption","Chemistry of Materials","2019","31","16","6210","","10.1021/acs.chemmater.9b02165","","","0.71073","MoKα","","0.1402","0.0803","","","0.1994","0.2395","","","","","","1.033","","","","has coordinates,has disorder","301811","2025-08-19","19:33:37",""
"4003000","13.739","0.0013","19.3401","0.0019","21.343","0.002","90","","90","","90","","5671.1","0.9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H14 Ba5 Cl10 F20 O27 -","- C20 Ba5 Cl10 F20 O27 -","- C80 Ba20 Cl40 F80 O108 -","4","1","","Dissanayake, K. Tauni; Amarasinghe, Dinesh K.; Suescun, Leopoldo; Rabuffetti, Federico A.","Accessing Mixed-Halide Upconverters Using Heterohaloacetate Precursors","Chemistry of Materials","2019","31","16","6262","","10.1021/acs.chemmater.9b02384","","","0.71073","MoKα","","0.0861","0.0572","","","0.1068","0.1183","","","","","","1.013","","","","has coordinates,has disorder","220423","2020-10-21","18:00:00",""
"4003001","18.6737","0.0004","18.6737","0.0004","38.3967","0.001","90","","90","","120","","11595.4","0.5","95","2","95","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C12 H7 Cu O7 -","- C12 H7 Cu O7 -","- C216 H126 Cu18 O126 -","18","0.5","","Tian, Yuanmeng; Liang, Gan; Fan, Tao; Shang, Jin; Shang, Shanshan; Ma, Yunsheng; Matsuda, Ryotaro; Liu, Mingxian; Wang, Man; Li, Liangchun; Kitagawa, Susumu","Grafting Free Carboxylic Acid Groups onto the Pore Surface of 3D Porous Coordination Polymers for High Proton Conductivity","Chemistry of Materials","2019","31","20","8494","","10.1021/acs.chemmater.9b02924","","","0.71073","MoKα","","0.0578","0.0539","","","0.1857","0.1878","","","","","","1.176","","","","has coordinates,has disorder","220424","2020-10-21","18:00:00",""
"4003002","18.8598","0.0006","18.8598","0.0006","37.7513","0.0018","90","","90","","120","","11628.8","0.8","273","2","273","2","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","","- C13 H5 Cu O9 -","- C13 H5 Cu O9 -","- C234 H90 Cu18 O162 -","18","0.5","","Tian, Yuanmeng; Liang, Gan; Fan, Tao; Shang, Jin; Shang, Shanshan; Ma, Yunsheng; Matsuda, Ryotaro; Liu, Mingxian; Wang, Man; Li, Liangchun; Kitagawa, Susumu","Grafting Free Carboxylic Acid Groups onto the Pore Surface of 3D Porous Coordination Polymers for High Proton Conductivity","Chemistry of Materials","2019","31","20","8494","","10.1021/acs.chemmater.9b02924","","","0.71073","MoKα","","0.1238","0.1069","","","0.2759","0.2903","","","","","","1.229","","","","has coordinates,has disorder","220425","2020-10-21","18:00:00",""
"4003003","15.4911","0.0009","5.4136","0.0003","33.149","0.003","90","","97.184","0.006","90","","2758.1","0.3","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H38 Cl0 N2 O0 S4 -","- C28 H38 N2 S4 -","- C112 H152 N8 S16 -","4","1","","Cao, Zhixiong; Chen, Jiale; Liu, Shengjian; Qin, Minchao; Jia, Tao; Zhao, Jiaji; Li, Qingduan; Ying, Lei; Cai, Yue-Peng; Lu, Xinhui; Huang, Fei; Cao, Yong","Understanding of Imine Substitution in Wide-Bandgap Polymer Donor-Induced Efficiency Enhancement in All-Polymer Solar Cells","Chemistry of Materials","2019","31","20","8533","","10.1021/acs.chemmater.9b03570","","x-ray","1.54184","CuKα","","0.0874","0.0626","","","0.1591","0.1771","","","","","","1.029","","","","has coordinates","220426","2020-10-21","18:00:00",""
"4003004","12.5046","0.0006","7.6471","0.0003","12.9975","0.0006","90","","90","","90","","1242.87","0.1","100","2","100","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- As8 Mg3 Si3 -","- As8 Mg3 Si3 -","- As32 Mg12 Si12 -","4","0.5","","Wang, Jian; Mark, Justin; Woo, Katherine E.; Voyles, Jackson; Kovnir, Kirill","Chemical Flexibility of Mg in Pnictide Materials: Structure and Properties Diversity","Chemistry of Materials","2019","31","20","8286","","10.1021/acs.chemmater.9b03740","","","0.71073","MoKα","","0.0137","0.012","","","0.0268","0.0283","","","","","","1.273","","","","has coordinates","220427","2020-10-21","18:00:00",""
"4003005","29.7184","0.0013","6.1756","0.0003","12.247","0.0005","90","","92.7847","0.001","90","","2245.02","0.17","298","2","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 I4 N2 Pb S2 -","- C12 H18 I4 N2 Pb S2 -","- C48 H72 I16 N8 Pb4 S8 -","4","0.5","","Jana, Manoj K.; Liu, Chi; Lidin, Sven; Dirkes, David J.; You, Wei; Blum, Volker; Mitzi, David B.","Resolving Rotational Stacking Disorder and Electronic Level Alignment in a 2D Oligothiophene-Based Lead Iodide Perovskite","Chemistry of Materials","2019","31","20","8523","","10.1021/acs.chemmater.9b03208","","","0.71073","MoKα","","0.0642","0.0548","","","0.2025","0.2168","","","","","","1.197","","","","has coordinates,has disorder","220428","2020-10-21","18:00:00",""
"4003006","18.6809","0.0009","19.188","0.003","12.7644","0.0006","90","","90","","90","","4575.4","0.8","280","0.1","280","0.1","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C2 H14 I4 N4 Pb -","- C2 H12.9572 I4 N4 Pb -","- C24 H155.486 I48 N48 Pb12 -","12","1.5","","Mączka, Mirosław; Ptak, Maciej; Gągor, Anna; Stefańska, Dagmara; Sieradzki, Adam","Layered Lead Iodide of [Methylhydrazinium]2PbI4 with a Reduced Band Gap: Thermochromic Luminescence and Switchable Dielectric Properties Triggered by Structural Phase Transitions","Chemistry of Materials","2019","31","20","8563","","10.1021/acs.chemmater.9b03775","","x-ray","0.71073","MoKα","","0.0787","0.0437","","","0.092","0.1075","","","","","","1.129","","","","has coordinates,has disorder","220429","2020-10-21","18:00:00",""
"4003007","18.466","0.0007","19.0768","0.0011","12.638","0.001","89.996","0.004","90.032","0.005","90.004","0.005","4452","0.5","99.98","0.13","99.98","0.13","","","","","","","","5","P -1","-P 1","2","","","","- C2 H14 I4 N4 Pb -","- C2 H14 I4 N4 Pb -","- C24 H168 I48 N48 Pb12 -","12","6","","Mączka, Mirosław; Ptak, Maciej; Gągor, Anna; Stefańska, Dagmara; Sieradzki, Adam","Layered Lead Iodide of [Methylhydrazinium]2PbI4 with a Reduced Band Gap: Thermochromic Luminescence and Switchable Dielectric Properties Triggered by Structural Phase Transitions","Chemistry of Materials","2019","31","20","8563","","10.1021/acs.chemmater.9b03775","","x-ray","0.71073","MoKα","","0.1249","0.0679","","","0.1649","0.2072","","","","","","0.983","","","","has coordinates","220430","2020-10-21","18:00:00",""
"4003008","35.1264","0.0011","27.9091","0.001","29.5657","0.0012","90","","90","","90","","28984.6","1.8","160","","160","","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C89.5 H86.9 Ag29 Cs3 N5.75 O7 S24 -","- C89.5 H86.9 Ag29 Cs3 N5.75 O7 S24 -","- C716 H695.2 Ag232 Cs24 N46 O56 S192 -","8","1","","Wei, Xiao; Kang, Xi; Yuan, Qianqin; Qin, Chenwanli; Jin, Shan; Wang, Shuxin; Zhu, Manzhou","Capture of Cesium Ions with Nanoclusters: Effects on Inter- and Intramolecular Assembly","Chemistry of Materials","2019","31","13","4945","","10.1021/acs.chemmater.9b01890","","","0.71073","MoKα","","0.0736","0.049","","","0.1305","0.1427","","","","","","1.038","","","","has coordinates,has disorder","220431","2020-10-21","18:00:00",""
"4003009","26.7649","0.0018","26.7649","0.0018","26.7649","0.0018","90","","90","","90","","19173","2","293","","293","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","catena-(tetrakis(m2-2-Butylimidazolato)-di-zinc)","","","- C14 H22 N4 Zn -","- C14 H22 N4 Zn -","- C672 H1056 N192 Zn48 -","48","0.5","","Titi, Hatem M.; Arhangelskis, Mihails; Katsenis, Athanassios D.; Mottillo, Cristina; Ayoub, Ghada; Do, Jean-Louis; Fidelli, Athena M.; Rogers, Robin D.; Friščić, Tomislav","Metal–Organic Frameworks as Fuels for Advanced Applications: Evaluating and Modifying the Combustion Energy of Popular MOFs","Chemistry of Materials","2019","31","13","4882","","10.1021/acs.chemmater.9b01488","powder diffraction","","1.5418","CuKα~1~","","","","","","","","","0.076","9.325","","","","","","","has coordinates","288246","2023-12-12","10:54:34",""
"4003010","35.4961","0.0019","11.188","0.0005","21.9119","0.0016","90","","94.224","0.011","90","","8678.2","0.9","292.15","","292.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","MUF-17","","- C32 H38 Co5 N4 O26 -","- C32 H38 Co5 N4 O26 -","- C256 H304 Co40 N32 O208 -","8","1","","Qazvini, Omid T.; Babarao, Ravichandar; Telfer, Shane G.","Multipurpose Metal‒Organic Framework for the Adsorption of Acetylene: Ethylene Purification and Carbon Dioxide Removal","Chemistry of Materials","2019","31","13","4919","","10.1021/acs.chemmater.9b01691","","x-ray","1.54178","CuKα","","0.199","0.1503","","","0.3628","0.4129","","","","","","1.42","","","","has coordinates","220433","2020-10-21","18:00:00",""
"4003011","3.3379","0.0005","3.3379","0.0005","12.2147","0.0018","90","","90","","120","","117.86","0.03","273","2","273","2","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Nb2 Pd0.45 S4 -","- Nb2 Pd0.45 S4 -","- Nb2 Pd0.45 S4 -","1","0.0416667","","Huang, Chong; Wang, Xin; Wang, Dong; Zhao, Wei; Bu, Kejun; Xu, Jijian; Huang, Xieyi; Bi, Qingyuan; Huang, Jian; Huang, Fuqiang","Atomic Pillar Effect in PdxNbS2 To Boost Basal Plane Activity for Stable Hydrogen Evolution","Chemistry of Materials","2019","31","13","4726","","10.1021/acs.chemmater.9b00821","","","0.71073","MoKα","","0.0294","0.0223","","","0.0478","0.0484","","","","","","1.085","","","","has coordinates","220434","2020-10-21","18:00:00",""
"4003012","5.502008","0.000009","2.948246","0.000004","4.059604","0.000007","90","","90","","90","","65.852","0.00018","300","","300","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","FeB","- B Fe -","- B Fe -","- B4 Fe4 -","4","0.5","","Bocarsly, Joshua D.; Levin, Emily E.; Humphrey, Samuel A.; Faske, Tom; Donner, Wolfgang; Wilson, Stephen D.; Seshadri, Ram","Magnetostructural Coupling Drives Magnetocaloric Behavior: The Case of MnB versus FeB","Chemistry of Materials","2019","31","13","4873","","10.1021/acs.chemmater.9b01476","powder diffraction","","0.414581","","","","","","","","","","","1.93","","","","","","","has coordinates","220435","2020-10-21","18:00:00",""
"4003013","5.563182","0.000006","2.97685","0.000003","4.147243","0.000004","90","","90","","90","","68.6815","0.00012","300","","300","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","MnB","- B Mn -","- B Mn -","- B4 Mn4 -","4","0.5","","Bocarsly, Joshua D.; Levin, Emily E.; Humphrey, Samuel A.; Faske, Tom; Donner, Wolfgang; Wilson, Stephen D.; Seshadri, Ram","Magnetostructural Coupling Drives Magnetocaloric Behavior: The Case of MnB versus FeB","Chemistry of Materials","2019","31","13","4873","","10.1021/acs.chemmater.9b01476","powder diffraction","","0.414581","","","","","","","","","","","1.93","","","","","","","has coordinates","220436","2020-10-21","18:00:00",""
"4003014","9.313","0.002","7.0555","0.0014","14.116","0.003","90","","97.977","0.004","90","","918.6","0.3","100","2","100","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C11 H23 Cl2 N5 O3 Ru S -","- C13 H7 Cl2 N5 O3 Ru S -","- C26 H14 Cl4 N10 O6 Ru2 S2 -","2","0.5","","Cole, Jacqueline M.; Velazquez-Garcia, Jose de J.; Gosztola, David J.; Wang, SuYin Grass; Chen, Yu-Sheng","Light-Induced Macroscopic Peeling of Single Crystal Driven by Photoisomeric Nano-Optical Switching","Chemistry of Materials","2019","31","13","4927","","10.1021/acs.chemmater.9b01738","","","0.41328","synchrotron","","0.0656","0.0543","","","0.1368","0.1449","","","","","","1.061","","","","has coordinates,has disorder","220437","2020-10-21","18:00:00",""
"4003015","9.224","0.003","7.117","0.002","14.262","0.005","90","","99.945","0.005","90","","922.2","0.5","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C11 H23 Cl2 N5 O3 Ru S -","- C11 H15 Cl2 N5 O3 Ru S -","- C22 H30 Cl4 N10 O6 Ru2 S2 -","2","1","","Cole, Jacqueline M.; Velazquez-Garcia, Jose de J.; Gosztola, David J.; Wang, SuYin Grass; Chen, Yu-Sheng","Light-Induced Macroscopic Peeling of Single Crystal Driven by Photoisomeric Nano-Optical Switching","Chemistry of Materials","2019","31","13","4927","","10.1021/acs.chemmater.9b01738","","","0.41328","synchrotron","","0.0831","0.0553","","","0.1269","0.1452","","","","","","1.028","","","","has coordinates,has disorder","220438","2020-10-21","18:00:00",""
"4003016","10.3676","0.0002","5.99871","0.00012","4.71309","0.00009","90","","90","","90","","293.118","0.01","293","","293","","","","","","","","","4","P 21 m a","P -2a 2a","26","","","","- Fe1.055 Li0.945 O4 P0.837 -","- Fe1.068 Li0.93201 O4 P0.841 -","- Fe4.272 Li3.72804 O16 P3.364 -","4","1","","Sumanov, Vasily D.; Aksyonov, Dmitry A.; Drozhzhin, Oleg A.; Presniakov, Igor; Sobolev, Alexey V.; Glazkova, Iana; Tsirlin, Alexander A.; Rupasov, Dmitry; Senyshyn, Anatoliy; Kolesnik, Irina V.; Stevenson, Keith J.; Antipov, Evgeny; Abakumov, Artem M.","“Hydrotriphylites” Li1‒xFe1+x(PO4)1‒y(OH)4y as Cathode Materials for Li-ion Batteries","Chemistry of Materials","2019","31","14","5035","","10.1021/acs.chemmater.9b00627","powder diffraction","neutron","1.54733","neutron","","0.0277","0.0277","","0.0368","0.0368","","","","1.64","","","","","","","has coordinates","220439","2020-10-21","18:00:00",""
"4003017","10.3385","0.0002","5.99521","0.00013","4.70108","0.0001","90","","90","","90","","291.38","0.01","293","","293","","","","","","","","","4","P 21 m a","P -2a 2a","26","","","","- Fe1.035 Li0.965 O4 P0.905 -","- Fe1.0354 Li0.96503 O4 P0.906 -","- Fe4.1416 Li3.86012 O16 P3.624 -","4","1","","Sumanov, Vasily D.; Aksyonov, Dmitry A.; Drozhzhin, Oleg A.; Presniakov, Igor; Sobolev, Alexey V.; Glazkova, Iana; Tsirlin, Alexander A.; Rupasov, Dmitry; Senyshyn, Anatoliy; Kolesnik, Irina V.; Stevenson, Keith J.; Antipov, Evgeny; Abakumov, Artem M.","“Hydrotriphylites” Li1‒xFe1+x(PO4)1‒y(OH)4y as Cathode Materials for Li-ion Batteries","Chemistry of Materials","2019","31","14","5035","","10.1021/acs.chemmater.9b00627","powder diffraction","neutron","1.5472","neutron","","0.018","0.0179","","0.0267","0.0267","","","","1.52","","","","","","","has coordinates","220440","2020-10-21","18:00:00",""
"4003018","43.611","0.003","7.3973","0.0005","7.1455","0.0005","90","","96.283","0.004","90","","2291.3","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Organic compound","","","- C28 H6 F10 O2 S2 -","- C28 H6 F10 O2 S2 -","- C112 H24 F40 O8 S8 -","4","0.5","","Usta, Hakan; Kim, Dojeon; Ozdemir, Resul; Zorlu, Yunus; Kim, Sanghyo; Ruiz Delgado, M. Carmen; Harbuzaru, Alexandra; Kim, Seonhyoung; Demirel, Gökhan; Hong, Jongin; Ha, Young-Geun; Cho, Kilwon; Facchetti, Antonio; Kim, Myung-Gil","High Electron Mobility in [1]Benzothieno[3,2-b][1]benzothiophene-Based Field-Effect Transistors: Toward n-Type BTBTs","Chemistry of Materials","2019","31","14","5254","","10.1021/acs.chemmater.9b01614","","","0.71073","MoKα","","0.0488","0.0391","","","0.0986","0.104","","","","","","1.035","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003019","5.564","0.003","5.564","0.003","5.564","0.003","90","","90","","90","","172.25","0.16","180","2","180","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs Mn0.1 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0516","0.0516","","","0.1392","0.1392","","","","","","1.256","","","","has coordinates,has disorder","220442","2020-10-21","18:00:00",""
"4003020","5.5377","0.0007","5.5377","0.0007","5.5377","0.0007","90","","90","","90","","169.82","0.04","230","2","230","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs Mn0.1 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0193","0.0193","","","0.0489","0.0489","","","","","","1.188","","","","has coordinates,has disorder","220442","2020-10-21","18:00:00",""
"4003021","5.5519","0.0008","5.5519","0.0008","5.5519","0.0008","90","","90","","90","","171.13","0.04","300","2","300","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs Mn0.1 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","- Cl3 Cs Mn0.0998 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0173","0.0173","","","0.0431","0.0431","","","","","","1.272","","","","has coordinates,has disorder","220442","2020-10-21","18:00:00",""
"4003022","5.507","0.002","5.507","0.002","5.507","0.002","90","","90","","90","","167.01","0.11","180","2","179.97","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs In0.07 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0657","0.0588","","","0.166","0.1753","","","","","","1.2","","","","has coordinates,has disorder","220443","2020-10-21","18:00:00",""
"4003023","5.5382","0.0011","5.5382","0.0011","5.5382","0.0011","90","","90","","90","","169.87","0.06","230","2","229.97","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs In0.07 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0297","0.0297","","","0.059","0.059","","","","","","1.318","","","","has coordinates,has disorder","220443","2020-10-21","18:00:00",""
"4003024","5.5592","0.0009","5.5592","0.0009","5.5592","0.0009","90","","90","","90","","171.81","0.05","298","2","298.03","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl3 Cs In0.07 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","- Cl3 Cs In0.0672 Sn0.9 -","1","0.0208333","","Wu, Ziyan; Zhang, Qiqi; Li, Binghan; Shi, Zhifang; Xu, Kaimin; Chen, Yi; Ning, Zhijun; Mi, Qixi","Stabilizing the CsSnCl3 Perovskite Lattice by B-Site Substitution for Enhanced Light Emission","Chemistry of Materials","2019","31","14","4999","","10.1021/acs.chemmater.9b00433","","","0.71073","MoKα","","0.0162","0.0162","","","0.0342","0.0342","","","","","","1.31","","","","has coordinates,has disorder","220443","2020-10-21","18:00:00",""
"4003025","8.2432","0.0017","8.2432","0.0017","10.021","0.002","90","","90","","120","","589.7","0.2","293","2","293","2","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Bi2 Cl3 Cs3 I6 -","- Bi2 Cl3 Cs3 I6 -","- Bi2 Cl3 Cs3 I6 -","1","0.0833333","","McCall, Kyle M.; Stoumpos, Constantinos C.; Kontsevoi, Oleg Y.; Alexander, Grant C. B.; Wessels, Bruce W.; Kanatzidis, Mercouri G.","From 0D Cs3Bi2I9 to 2D Cs3Bi2I6Cl3: Dimensional Expansion Induces a Direct Band Gap but Enhances Electron‒Phonon Coupling","Chemistry of Materials","2019","31","7","2644","","10.1021/acs.chemmater.9b00636","","","0.71073","MoKα","","0.0459","0.0426","","","0.1206","0.1242","","","","","","1.16","","","","has coordinates","220444","2020-10-21","18:00:00",""
"4003026","6.54","0.006","6.54","0.006","12.214","0.011","90","","90","","90","","522.4","0.8","297","2","297","2","","","","","","","","3","I 4/m","-I 4","87","","","","- Ba Be20 N14 -","- Ba Be20 N14 -","- Ba2 Be40 N28 -","2","0.125","","Elzer, Eugenia; Niklaus, Robin; Strobel, Philipp J.; Weiler, Volker; Schmidt, Peter J.; Schnick, Wolfgang","MBe20N14:Eu2+ (M = Sr, Ba): Highly Condensed Nitridoberyllates with Exceptional Highly Energetic Eu2+ Luminescence","Chemistry of Materials","2019","31","9","3174","","10.1021/acs.chemmater.8b05133","","","0.71073","MoKα","","0.0274","0.0271","","","0.058","0.0581","","","","","","1.082","","","","has coordinates","220445","2020-10-21","18:00:00",""
"4003027","6.5241","0.0008","6.5241","0.0008","12.1357","0.0017","90","","90","","90","","516.54","0.12","293","2","293","2","","","","","","","","3","I 4/m","-I 4","87","","","","- Be20 Eu N14 -","- Be20 Eu N14 -","- Be40 Eu2 N28 -","2","0.125","","Elzer, Eugenia; Niklaus, Robin; Strobel, Philipp J.; Weiler, Volker; Schmidt, Peter J.; Schnick, Wolfgang","MBe20N14:Eu2+ (M = Sr, Ba): Highly Condensed Nitridoberyllates with Exceptional Highly Energetic Eu2+ Luminescence","Chemistry of Materials","2019","31","9","3174","","10.1021/acs.chemmater.8b05133","","","0.71073","MoKα","","0.0161","0.016","","","0.032","0.032","","","","","","1.122","","","","has coordinates","220446","2020-10-21","18:00:00",""
"4003028","6.525","0.002","6.525","0.002","12.133","0.004","90","","90","","90","","516.6","0.3","293","2","293","2","","","","","","","","3","I 4/m","-I 4","87","SrBe20N14","","","- Be20 N14 Sr -","- Be20 N14 Sr -","- Be40 N28 Sr2 -","2","0.125","","Elzer, Eugenia; Niklaus, Robin; Strobel, Philipp J.; Weiler, Volker; Schmidt, Peter J.; Schnick, Wolfgang","MBe20N14:Eu2+ (M = Sr, Ba): Highly Condensed Nitridoberyllates with Exceptional Highly Energetic Eu2+ Luminescence","Chemistry of Materials","2019","31","9","3174","","10.1021/acs.chemmater.8b05133","","","0.71073","MoKα","","0.0409","0.0324","","","0.052","0.0542","","","","","","1.126","","","","has coordinates","220447","2020-10-21","18:00:00",""
"4003029","5.4475","0.0001","5.4475","0.0001","5.4475","0.0001","90","","90","","90","","161.656","0.005","100","2","100","2","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","","","","- Ni P2 -","- Ni P2 -","- Ni4 P8 -","4","0.166667","","Owens-Baird, Bryan; Xu, Junyuan; Petrovykh, Dmitri Y.; Bondarchuk, Oleksandr; Ziouani, Yasmine; González-Ballesteros, Noelia; Yox, Philip; Sapountzi, Foteini M.; Niemantsverdriet, Hans; Kolen’ko, Yury V.; Kovnir, Kirill","NiP2: A Story of Two Divergent Polymorphic Multifunctional Materials","Chemistry of Materials","2019","31","9","3407","","10.1021/acs.chemmater.9b00565","","","0.71073","MoKα","","0.0214","0.0189","","","0.0393","0.0401","","","","","","1.223","","","","has coordinates","220448","2020-10-21","18:00:00",""
"4003030","6.3742","0.0003","5.6156","0.0003","5.6288","0.0003","90","","119.628","0.002","90","","175.139","0.016","100","2","100","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Ni P2 -","- Ni P2 -","- Ni4 P8 -","4","0.5","","Owens-Baird, Bryan; Xu, Junyuan; Petrovykh, Dmitri Y.; Bondarchuk, Oleksandr; Ziouani, Yasmine; González-Ballesteros, Noelia; Yox, Philip; Sapountzi, Foteini M.; Niemantsverdriet, Hans; Kolen’ko, Yury V.; Kovnir, Kirill","NiP2: A Story of Two Divergent Polymorphic Multifunctional Materials","Chemistry of Materials","2019","31","9","3407","","10.1021/acs.chemmater.9b00565","","","0.71073","MoKα","","0.0184","0.0179","","","0.0392","0.0394","","","","","","1.228","","","","has coordinates","220449","2020-10-21","18:00:00",""
"4003031","6.1145","0.0001","28.731","0.0005","8.9259","0.0002","90","","91.487","0.002","90","","1567.54","0.05","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 Br4 N2 O2 Pb -","- C6 H18 Br4 N2 O2 Pb -","- C24 H72 Br16 N8 O8 Pb4 -","4","1","","Zhou, Guojun; Jiang, Xingxing; Molokeev, Maxim; Lin, Zheshuai; Zhao, Jing; Wang, Jing; Xia, Zhiguo","Optically Modulated Ultra-Broad-Band Warm White Emission in Mn2±Doped (C6H18N2O2)PbBr4 Hybrid Metal Halide Phosphor","Chemistry of Materials","2019","31","15","5788","","10.1021/acs.chemmater.9b01864","","x-ray","1.54184","CuKα","","0.0239","0.0226","","","0.0587","0.0596","","","","","","1.063","","","","has coordinates","273129","2022-02-23","10:11:32",""
"4003032","24.4853","0.0011","42.1654","0.0014","17.1403","0.0006","90","","90","","90","","17696.2","1.2","150","2","150","2","","","","","","","","4","C m c m","-C 2c 2","63","LIFM-114-Ethanol","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54178","CuKα","","0.0958","0.0706","","","0.1983","0.2197","","","","","","1.066","","","","has coordinates,has disorder","220451","2020-10-21","18:00:00",""
"4003033","16.1063","0.0007","28.5501","0.0008","40.9518","0.0009","90","","90","","90","","18831.1","1.1","150","2","150","2","","","","","","","","4","F m m m","-F 2 2","69","LIFM-114-Water","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.125","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.0772","0.073","","","0.1992","0.2035","","","","","","1.042","","","","has coordinates,has disorder","220452","2020-10-21","18:00:00",""
"4003034","21.4419","0.0008","42.3169","0.001","17.9262","0.0005","90","","90","","90","","16265.4","0.8","150","2","150","2","","","","","","","","4","C m m m","-C 2 2","65","LIFM-114-DCM","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.1428","0.1295","","","0.3874","0.4043","","","","","","1.692","","","","has coordinates,has disorder","220453","2020-10-21","18:00:00",""
"4003035","16.0688","0.0007","28.8004","0.0015","41.0306","0.0017","90","","90","","90","","18988.5","1.5","150","2","150","2","","","","","","","","4","F m m m","-F 2 2","69","LIFM-114","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.125","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.0474","0.0444","","","0.1427","0.1457","","","","","","1.13","","","","has coordinates,has disorder","220454","2020-10-21","18:00:00",""
"4003036","21.1937","0.0018","42.4945","0.0015","17.8951","0.0006","90","","90","","90","","16116.6","1.6","150","2","150","2","","","","","","","","4","C m m m","-C 2 2","65","LIFM-114-Acetone","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.1278","0.1175","","","0.3434","0.3607","","","","","","1.609","","","","has coordinates,has disorder","220455","2020-10-21","18:00:00",""
"4003037","25.7916","0.0015","41.7841","0.0011","16.8545","0.0004","90","","90","","90","","18163.7","1.2","149.99","0.1","149.99","0.1","","","","","","","","4","C m m m","-C 2 2","65","LIFM-114-40C","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54178","CuKα","","0.1232","0.1139","","","0.3225","0.3333","","","","","","1.078","","","","has coordinates,has disorder","220456","2020-10-21","18:00:00",""
"4003038","26.6952","0.0015","41.2943","0.0011","16.8339","0.0006","90","","90","","90","","18557","1.3","150","2","150","2","","","","","","","","4","C m c m","-C 2c 2","63","LIFM-114-Toluene","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.0962","0.0808","","","0.2438","0.2535","","","","","","1.065","","","","has coordinates,has disorder","220457","2020-10-21","18:00:00",""
"4003039","20.557","0.002","42.7525","0.0017","17.8758","0.0007","90","","90","","90","","15710.4","1.8","150","2","150","2","","","","","","","","4","C m m m","-C 2 2","65","LIFM-114-Ether","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.1492","0.1298","","","0.3497","0.3751","","","","","","1.545","","","","has coordinates,has disorder","220458","2020-10-21","18:00:00",""
"4003040","21.0637","0.0007","42.3687","0.0011","18.0144","0.0004","90","","90","","90","","16076.8","0.8","150","0.1","150","0.1","","","","","","","","4","C m m m","-C 2 2","65","LIFM-114-80C","","","- C108 H64 O32 Zr6 -","- C108 H64 O32 Zr6 -","- C432 H256 O128 Zr24 -","4","0.25","","Chen, Cheng-Xia; Wei, Zhang-Wen; Cao, Chen-Chen; Yin, Shao-Yun; Qiu, Qian-Feng; Zhu, Neng-Xiu; Xiong, Yang-Yang; Jiang, Ji-Jun; Pan, Mei; Su, Cheng-Yong","All Roads Lead to Rome: Tuning the Luminescence of a Breathing Catenated Zr-MOF by Programmable Multiplexing Pathways","Chemistry of Materials","2019","31","15","5550","","10.1021/acs.chemmater.9b01258","","x-ray","1.54184","CuKα","","0.1524","0.136","","","0.3562","0.3721","","","","","","1","","","","has coordinates,has disorder","220459","2020-10-21","18:00:00",""
"4003041","8.0335","0.0016","13.03","0.003","18.499","0.004","103.47","0.03","97.48","0.03","105.21","0.03","1779","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C2.56 H1.94 N0.22 O0.22 -","- C2.55556 H2 N0.222222 O0.222222 -","- C92 H72 N8 O8 -","36","18","","Wang, Xuan; Ma, Huili; Gu, Mingxing; Lin, Changqing; Gan, Nan; Xie, Zongliang; Wang, He; Bian, Lifang; Fu, Lishun; Cai, Suzhi; Chi, Zhenguo; Yao, Wei; An, Zhongfu; Shi, Huifang; Huang, Wei","Multicolor Ultralong Organic Phosphorescence through Alkyl Engineering for 4D Coding Applications","Chemistry of Materials","2019","31","15","5584","","10.1021/acs.chemmater.9b01304","","","0.71073","MoKα","","0.1305","0.084","","","0.1669","0.1854","","","","","","1.168","","","","has coordinates","220460","2020-10-21","18:00:00",""
"4003042","9.362","0.002","11.627","0.003","15.805","0.004","90","","90","","90","","1720.4","0.7","296","2","296.31","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H16 N2 O2 -","- C22 H16 N2 O2 -","- C88 H64 N8 O8 -","4","1","","Wang, Xuan; Ma, Huili; Gu, Mingxing; Lin, Changqing; Gan, Nan; Xie, Zongliang; Wang, He; Bian, Lifang; Fu, Lishun; Cai, Suzhi; Chi, Zhenguo; Yao, Wei; An, Zhongfu; Shi, Huifang; Huang, Wei","Multicolor Ultralong Organic Phosphorescence through Alkyl Engineering for 4D Coding Applications","Chemistry of Materials","2019","31","15","5584","","10.1021/acs.chemmater.9b01304","","","0.71073","MoKα","","0.0595","0.043","","","0.1003","0.1086","","","","","","1.028","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003043","16.771","0.003","13.662","0.002","8.2368","0.0013","90","","90","","90","","1887.3","0.5","298","2","297.89","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C24 H20 N2 O2 -","- C24 H20 N2 O2 -","- C96 H80 N8 O8 -","4","1","","Wang, Xuan; Ma, Huili; Gu, Mingxing; Lin, Changqing; Gan, Nan; Xie, Zongliang; Wang, He; Bian, Lifang; Fu, Lishun; Cai, Suzhi; Chi, Zhenguo; Yao, Wei; An, Zhongfu; Shi, Huifang; Huang, Wei","Multicolor Ultralong Organic Phosphorescence through Alkyl Engineering for 4D Coding Applications","Chemistry of Materials","2019","31","15","5584","","10.1021/acs.chemmater.9b01304","","","0.71073","MoKα","","0.0392","0.0358","","","0.0847","0.0866","","","","","","1.094","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003044","16.813","0.003","7.4763","0.0015","31.999","0.006","90","","90","","90","","4022.2","1.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C25 H22 N2 O2 -","- C25 H22 N2 O2 -","- C200 H176 N16 O16 -","8","1","","Wang, Xuan; Ma, Huili; Gu, Mingxing; Lin, Changqing; Gan, Nan; Xie, Zongliang; Wang, He; Bian, Lifang; Fu, Lishun; Cai, Suzhi; Chi, Zhenguo; Yao, Wei; An, Zhongfu; Shi, Huifang; Huang, Wei","Multicolor Ultralong Organic Phosphorescence through Alkyl Engineering for 4D Coding Applications","Chemistry of Materials","2019","31","15","5584","","10.1021/acs.chemmater.9b01304","","","0.71073","MoKα","","0.1006","0.0519","","","0.1192","0.1495","","","","","","1.091","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003045","6.93886","0.00014","8.694","0.0002","12.4532","0.0003","88.911","0.002","87.481","0.002","68.358","0.002","697.62","0.03","295","","295","","","","","","","","","4","P -1","-P 1","2","","tetra-aqua-(2,5-dihydroxyterephthalato)-cobalt dihydrate","","- C8 H16 Co O12 -","- C8 H16 Co O12 -","- C16 H32 Co2 O24 -","2","1","","Ayoub, Ghada; Karadeniz, Bahar; Howarth, Ashlee J.; Farha, Omar K.; Đilović, Ivica; Germann, Luzia S.; Dinnebier, Robert E.; Užarević, Krunoslav; Friščić, Tomislav","Rational Synthesis of Mixed-Metal Microporous Metal‒Organic Frameworks with Controlled Composition Using Mechanochemistry","Chemistry of Materials","2019","31","15","5494","","10.1021/acs.chemmater.9b01068","powder diffraction","","0.7093","MoKα~1~","","1.24","","","","","","","","2.7","","","","","","","has coordinates","220464","2020-10-21","18:00:00",""
"4003046","6.9497","0.0005","8.6455","0.0005","12.4065","0.0009","89.144","0.005","87.701","0.006","67.707","0.006","689.16","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H16 Ni O12 -","- C8 H16 Ni O12 -","- C16 H32 Ni2 O24 -","2","1","","Ayoub, Ghada; Karadeniz, Bahar; Howarth, Ashlee J.; Farha, Omar K.; Đilović, Ivica; Germann, Luzia S.; Dinnebier, Robert E.; Užarević, Krunoslav; Friščić, Tomislav","Rational Synthesis of Mixed-Metal Microporous Metal‒Organic Frameworks with Controlled Composition Using Mechanochemistry","Chemistry of Materials","2019","31","15","5494","","10.1021/acs.chemmater.9b01068","","","1.54184","CuKα","","0.0548","0.0494","","","0.1289","0.1355","","","","","","1.062","","","","has coordinates","220465","2020-10-21","18:00:00",""
"4003047","4.618","0.006","12.47","0.017","15.1","0.02","89.59","0.02","82.08","0.02","83.28","0.02","855","2","260","2","260","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H19 I3 N2 O Pb -","- C7 H19 I3 N2 O Pb -","- C14 H38 I6 N4 O2 Pb2 -","2","1","","Dahlman, Clayton J.; DeCrescent, Ryan A.; Venkatesan, Naveen R.; Kennard, Rhys M.; Wu, Guang; Everest, Michael A.; Schuller, Jon A.; Chabinyc, Michael L.","Controlling Solvate Intermediate Growth for Phase-Pure Organic Lead Iodide Ruddlesden‒Popper (C4H9NH3)2(CH3NH3)n−1PbnI3n+1 Perovskite Thin Films","Chemistry of Materials","2019","31","15","5832","","10.1021/acs.chemmater.9b01952","","","0.71073","MoKα","","0.1146","0.0492","","","0.0739","0.0856","","","","","","0.874","","","","has coordinates","220466","2020-10-21","18:00:00",""
"4003048","4.5723","0.0002","25.3424","0.0011","12.1782","0.0005","90","","96.075","0.003","90","","1403.2","0.1","260","2","260","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H13 I3 N2 O Pb -","- C4 H13 I3 N2 O Pb -","- C16 H52 I12 N8 O4 Pb4 -","4","1","","Dahlman, Clayton J.; DeCrescent, Ryan A.; Venkatesan, Naveen R.; Kennard, Rhys M.; Wu, Guang; Everest, Michael A.; Schuller, Jon A.; Chabinyc, Michael L.","Controlling Solvate Intermediate Growth for Phase-Pure Organic Lead Iodide Ruddlesden‒Popper (C4H9NH3)2(CH3NH3)n−1PbnI3n+1 Perovskite Thin Films","Chemistry of Materials","2019","31","15","5832","","10.1021/acs.chemmater.9b01952","","","0.71073","MoKα","","0.1267","0.074","","","0.1674","0.1898","","","","","","1.043","","","","has coordinates","220467","2020-10-21","18:00:00",""
"4003049","18.3099","0.0004","10.9142","0.0003","8.4635","0.0002","90","","90","","90","","1691.33","0.07","200","2","200","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C4 H14 Bi I5 N2 -","- C4 H14 Bi I5 N2 -","- C16 H56 Bi4 I20 N8 -","4","1","","Tao, Kewen; Li, Yaobin; Ji, Chengmin; Liu, Xitao; Wu, Zhenyue; Han, Shiguo; Sun, Zhihua; Luo, Junhua","A Lead-Free Hybrid Iodide with Quantitative Response to X-ray Radiation","Chemistry of Materials","2019","31","15","5927","","10.1021/acs.chemmater.9b02263","","","0.71073","MoKα","","0.0704","0.0664","","","0.1737","0.1775","","","","","","1.094","","","","has coordinates","220468","2020-10-21","18:00:00",""
"4003050","7.819","0.003","6.147","0.003","6.133","0.002","105.28","0.04","103.21","0.05","96.37","0.05","272.2","0.2","293","","293","","","","","","","","","3","P -1","-P 1","2","","","","- O7 P2 V -","- O7 P2 V -","- O14 P4 V2 -","2","1","","Drozhzhin, Oleg A.; Tertov, Ilya V.; Alekseeva, Anastasia M.; Aksyonov, Dmitry A.; Stevenson, Keith J.; Abakumov, Artem M.; Antipov, Evgeny V.","β-NaVP2O7 as a Superior Electrode Material for Na-Ion Batteries","Chemistry of Materials","2019","31","18","7463","","10.1021/acs.chemmater.9b02124","powder diffraction","x-ray","1.5406","CuKa1","","0.052","0.052","","0.0763","0.0763","","","","12.51","","","","","","","has coordinates","220469","2020-10-21","18:00:00",""
"4003051","7.1142","0.0007","10.0709","0.0007","8.0816","0.0006","90","","109.091","0.009","90","","547.17","0.08","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Na O7 P2 V -","- Na O7 P2 V -","- Na4 O28 P8 V4 -","4","1","","Drozhzhin, Oleg A.; Tertov, Ilya V.; Alekseeva, Anastasia M.; Aksyonov, Dmitry A.; Stevenson, Keith J.; Abakumov, Artem M.; Antipov, Evgeny V.","β-NaVP2O7 as a Superior Electrode Material for Na-Ion Batteries","Chemistry of Materials","2019","31","18","7463","","10.1021/acs.chemmater.9b02124","powder diffraction","x-ray","1.54056","CuKa1","","0.0222","0.0222","","0.0315","0.0315","","","","2.76","","","","","","","has coordinates","220470","2020-10-21","18:00:00",""
"4003052","13.3591","0.0019","13.3591","0.0019","42.446","0.005","90","","90","","90","","7575.1","1.8","100","2","100.01","","","","","","","","","5","I 4/m","-I 4","87","","PFC-17","","- C11.75 H11.75 N11.75 O11.75 Zn11.75 -","- C20 H12 N9 O4 Zn2 -","- C160 H96 N72 O32 Zn16 -","8","0.5","","Li, Lan; Yi, Jun-Dong; Fang, Zhi-Bin; Wang, Xu-Sheng; Liu, Nan; Chen, Ya-Nan; Liu, Tian-Fu; Cao, Rong","Creating Giant Secondary Building Layers via Alkali-Etching Exfoliation for Precise Synthesis of Metal‒Organic Frameworks","Chemistry of Materials","2019","31","18","7584","","10.1021/acs.chemmater.9b02375","","","0.71073","MoKα","","0.0898","0.0846","","","0.214","0.217","","","","","","1.08","","","","has coordinates","220471","2020-10-21","18:00:00",""
"4003053","10.49049","0.00013","10.56034","0.00009","10.50156","0.00013","90","","90","","90","","1163.4","0.02","100","","100","","","","","","","","","4","F d d 2","F 2 -2d","43","","","Cd2Nb2O6.75S0.25","- Cd Nb O3.39 S0.11 -","- Cd Nb O3.39 S0.11 -","- Cd16 Nb16 O54.24 S1.76 -","16","1","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","2.05","","","","","","","has coordinates","220472","2020-10-21","18:00:00",""
"4003054","10.373405","0.000002","10.373405","0.000002","10.373405","0.000002","90","","90","","90","","1116.26","0.0004","340","","340","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Cd2Nb2O7","- Cd0.98 Nb O3.45 -","- Cd0.9785 Nb O3.447 -","- Cd15.656 Nb16 O55.152 -","16","0.0833333","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","1.02","","","","","","","has coordinates","220473","2020-10-21","18:00:00",""
"4003055","7.47367","0.00004","7.473783","0.000034","10.56693","0.00004","90","","90","","90","","590.233","0.005","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","Cd2Nb2O6.3S0.7","- Cd Nb O3.14 S0.36 -","- Cd Nb O3.14 S0.36 -","- Cd8 Nb8 O25.12 S2.88 -","8","2","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","1.99","","","","","","","has coordinates","220474","2020-10-21","18:00:00",""
"4003056","10.570977","0.000003","10.570977","0.000003","10.570977","0.000003","90","","90","","90","","1181.26","0.0006","440","","440","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Cd2Nb2O6.3S0.7","- Cd Nb O3.14 S0.36 -","- Cd Nb O3.1405 S0.3595 -","- Cd16 Nb16 O50.248 S5.752 -","16","0.0833333","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","1.12","","","","","","","has coordinates","220475","2020-10-21","18:00:00",""
"4003057","10.521513","0.000008","10.521513","0.000008","10.521513","0.000008","90","","90","","90","","1164.76","0.0015","340","","340","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Cd2Nb2O6.75S0.25","- Cd Nb O3.39 S0.11 -","- Cd Nb O3.3935 S0.106 -","- Cd16 Nb16 O54.296 S1.696 -","16","0.0833333","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","1.3","","","","","","","has coordinates","220476","2020-10-21","18:00:00",""
"4003058","7.320662","0.000007","10.370384","0.000012","7.330492","0.000009","90","","90","","90","","556.517","0.0011","100","","100","","","","","","","","","3","I m a 2","I 2 -2a","46","","","Cd2Nb2O7","- Cd0.98 Nb O3.45 -","- Cd0.98 Nb O3.45 -","- Cd7.84 Nb8 O27.6 -","8","1","","Laurita, Geneva; Hickox-Young, Daniel; Husremovic, Samra; Li, Jun; Sleight, Arthur W.; Macaluso, Robin; Rondinelli, James M.; Subramanian, Mas A.","Covalency-driven Structural Evolution in the Polar Pyrochlore Series Cd2Nb2O7‒xSx","Chemistry of Materials","2019","31","18","7626","","10.1021/acs.chemmater.9b02466","powder diffraction","","0.413781","","","","","","","","","","","1.09","","","","","","","has coordinates","220477","2020-10-21","18:00:00",""
"4003059","39.768","0.004","39.768","0.004","11.9155","0.0013","90","","90","","120","","16320","3","100","","100","","","","","","","","","5","P 6/m m m","-P 6 2","191","","","","- C17.12 H8 Br Hf1.5 O8 -","- C17.125 H8 Br Hf1.5 O8 -","- C205.5 H96 Br12 Hf18 O96 -","12","0.5","","Lyu, Jiafei; Zhang, Xuan; Li, Peng; Wang, Xingjie; Buru, Cassandra T.; Bai, Peng; Guo, Xianghai; Farha, Omar K.","Exploring the Role of Hexanuclear Clusters as Lewis Acidic Sites in Isostructural Metal‒Organic Frameworks","Chemistry of Materials","2019","31","11","4166","","10.1021/acs.chemmater.9b00960","","x-ray","0.71073","MoKα","","0.0349","0.0306","","","0.0838","0.0864","","","","","","1.066","","","","has coordinates,has disorder","220478","2020-10-21","18:00:00",""
"4003060","15.3654","0.0011","8.2286","0.0006","19.8784","0.0016","90","","98.196","0.003","90","","2487.7","0.3","90","0.2","90","0.2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H33 B F4 N O6 S -","- C24 H33 B F4 N O6 S -","- C96 H132 B4 F16 N4 O24 S4 -","4","1","","Attanayake, N. Harsha; Kowalski, Jeffrey A.; Greco, Katharine V.; Casselman, Matthew D.; Milshtein, Jarrod D.; Chapman, Steven J.; Parkin, Sean R.; Brushett, Fikile R.; Odom, Susan A.","Tailoring Two-Electron-Donating Phenothiazines To Enable High-Concentration Redox Electrolytes for Use in Nonaqueous Redox Flow Batteries","Chemistry of Materials","2019","31","12","4353","","10.1021/acs.chemmater.8b04770","","","0.71073","MoKα","","0.0365","0.0332","","","0.0853","0.0877","","","","","","1.034","","","","has coordinates","220479","2020-10-21","18:00:00",""
"4003061","4.4848","0.0006","9.8986","0.0013","20.4187","0.0007","90","","131.157","0.006","90","","682.48","0.14","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H5 N5 O2 -","- C6 H5 N5 O2 -","- C24 H20 N20 O8 -","4","1","","Hirsch, Anna; Palmer, Benjamin A.; Ramasubramaniam, Ashwin; Williams, P. Andrew; Harris, Kenneth D. M.; Pokroy, Boaz; Weiner, Steve; Addadi, Lia; Leiserowitz, Leslie; Kronik, Leeor","Structure and Morphology of Light-Reflecting Synthetic and Biogenic Polymorphs of Isoxanthopterin: A Comparison","Chemistry of Materials","2019","31","12","4479","","10.1021/acs.chemmater.9b01039","powder diffraction","x-ray","1.5406","","","","","","","","","0.34554","","1.13","","","","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003062","5.1316","0.0007","5.4889","0.0008","10.9666","0.0012","81.345","0.011","80.683","0.01","77.455","0.012","295.4","0.07","275","","275","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","1","0.5","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1313","0.0556","","0.0269","0.0248","0.0248","","","","","","0.9986","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003063","4.8906","0.0005","5.7517","0.0005","10.8475","0.0009","81.785","0.007","81.137","0.008","77.49","0.008","292.43","0.05","230","","230","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","1","0.5","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1333","0.0645","","0.1371","0.1249","0.1249","","","","","","0.9998","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003064","4.7821","0.0005","5.8258","0.0006","10.7018","0.001","81.926","0.008","81.568","0.008","76.993","0.008","285.57","0.05","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","1","0.5","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1078","0.076","","0.1978","0.1836","0.1836","","","","","","1","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003065","4.9887","0.0004","5.635","0.0005","10.9175","0.0008","81.612","0.006","80.726","0.006","77.499","0.007","293.74","0.04","250","","250","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","1","0.5","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1065","0.0549","","0.0659","0.0516","0.0516","","","","","","1","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003066","8.2924","0.0005","6.6543","0.0005","10.9934","0.0006","90","","101.594","0.006","90","","594.24","0.07","293","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C20 H12 Cl4 N4 O8 -","2","0.25","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1006","0.0511","","0.0168","0.0158","0.0158","","","","","","0.9993","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003067","4.8242","0.0003","5.8096","0.0003","10.7703","0.0006","81.848","0.005","81.421","0.005","77.317","0.005","289.33","0.03","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","1","0.5","","Liu, Huiyu; Gutmann, Matthias J.; Stokes, Harold T.; Campbell, Branton J.; Evans, Ivana Radosavljevic; Evans, John S. O.","Supercolossal Uniaxial Negative Thermal Expansion in Chloranilic Acid Pyrazine, CA-Pyz","Chemistry of Materials","2019","31","12","4514","","10.1021/acs.chemmater.9b01135","","","0.71073","MoKα","","0.1184","0.0758","","0.1801","0.171","0.171","","","","","","1","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003068","9.8897","0.001","31.038","0.003","9.657","0.0009","90","","90","","90","","2964.3","0.5","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H40 Br4 Cd N2 -","- C24 H40 Br4 Cd N2 -","- C96 H160 Br16 Cd4 N8 -","4","1","","Deswal, Swati; Singh, Sachin Kumar; Rambabu, P.; Kulkarni, Priyangi; Vaitheeswaran, G.; Praveenkumar, B.; Ogale, Satishchandra; Boomishankar, Ramamoorthy","Flexible Composite Energy Harvesters from Ferroelectric A2MX4-Type Hybrid Halogenometallates","Chemistry of Materials","2019","31","12","4545","","10.1021/acs.chemmater.9b01227","","","0.71073","MoKα","","0.0694","0.0573","","","0.1363","0.1454","","","","","","1.051","","","","has coordinates","220487","2020-10-21","18:00:00",""
"4003069","9.675","0.002","9.911","0.002","16.382","0.004","94.071","0.006","104.294","0.006","115.155","0.005","1349.9","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H36 Br4 Cd N2 -","- C22 H36 Br4 Cd N2 -","- C44 H72 Br8 Cd2 N4 -","2","1","","Deswal, Swati; Singh, Sachin Kumar; Rambabu, P.; Kulkarni, Priyangi; Vaitheeswaran, G.; Praveenkumar, B.; Ogale, Satishchandra; Boomishankar, Ramamoorthy","Flexible Composite Energy Harvesters from Ferroelectric A2MX4-Type Hybrid Halogenometallates","Chemistry of Materials","2019","31","12","4545","","10.1021/acs.chemmater.9b01227","","","0.71073","MoKα","","0.0556","0.0452","","","0.1147","0.1258","","","","","","1.047","","","","has coordinates","220488","2020-10-21","18:00:00",""
"4003070","9.554","0.004","9.071","0.004","15.206","0.006","90","","94.369","0.013","90","","1314","1","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H32 Br4 Cd N2 -","- C20 H32 Br4 Cd N2 -","- C40 H64 Br8 Cd2 N4 -","2","1","","Deswal, Swati; Singh, Sachin Kumar; Rambabu, P.; Kulkarni, Priyangi; Vaitheeswaran, G.; Praveenkumar, B.; Ogale, Satishchandra; Boomishankar, Ramamoorthy","Flexible Composite Energy Harvesters from Ferroelectric A2MX4-Type Hybrid Halogenometallates","Chemistry of Materials","2019","31","12","4545","","10.1021/acs.chemmater.9b01227","","","0.71073","MoKα","","0.0728","0.0604","","","0.1342","0.1392","","","","","","1.008","","","","has coordinates","220489","2020-10-21","18:00:00",""
"4003071","27.016","0.004","27.016","0.004","17.719","0.004","90","","90","","120","","11200","3","293","2","293","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C156 H220 I7 In9 N24 O66 -","- C87 H36 I7.02 In9 N6 O44.98 -","- C174 H72 I14.04 In18 N12 O89.96 -","2","0.166667","","Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian","Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation","Chemistry of Materials","2019","31","3","1084","","10.1021/acs.chemmater.8b04792","","","0.71073","MoKα","","0.0519","0.039","","","0.1119","0.1165","","","","","","1.053","","","","has coordinates,has disorder","220490","2020-10-21","18:00:00",""
"4003072","26.835","0.004","26.835","0.004","17.863","0.004","90","","90","","120","","11140","3","293","2","293","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C144 H193 Cl7 In9 N21 O63 -","- C84 H36 Cl7.02 In9 N6 O44.98 -","- C168 H72 Cl14.04 In18 N12 O89.96 -","2","0.166667","","Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian","Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation","Chemistry of Materials","2019","31","3","1084","","10.1021/acs.chemmater.8b04792","","","0.71073","MoKα","","0.1298","0.1074","","","0.2842","0.2986","","","","","","1.036","","","","has coordinates,has disorder","220491","2020-10-21","18:00:00",""
"4003073","26.945","0.004","26.945","0.004","17.792","0.004","90","","90","","120","","11187","3","293","2","293","2","","","","","","","","6","P -3 1 c","-P 3 2c","163","","","","- C144 H193 Br7 In9 N21 O63 -","- C84 H36 Br7.02 In9 N6 O44.98 -","- C168 H72 Br14.04 In18 N12 O89.96 -","2","0.166667","","Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian","Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation","Chemistry of Materials","2019","31","3","1084","","10.1021/acs.chemmater.8b04792","","","0.71073","MoKα","","0.0623","0.0519","","","0.1371","0.1413","","","","","","1.097","","","","has coordinates,has disorder","220492","2020-10-21","18:00:00",""
"4003074","12.1135","0.0003","3.83754","0.00009","5.2749","0.0002","90","","100.909","0.003","90","","240.778","0.013","295","","295","","","","14100000","","","","","2","C 1 2/m 1","-C 2y","12","","","NiBi2","- Bi2 Ni -","- Bi2 Ni -","- Bi8 Ni4 -","4","0.5","","Clarke, Samantha M.; Powderly, Kelly M.; Walsh, James P. S.; Yu, Tony; Wang, Yanbin; Meng, Yue; Jacobsen, Steven D.; Freedman, Danna E.","Controlling Dimensionality in the Ni‒Bi System with Pressure","Chemistry of Materials","2019","31","3","955","","10.1021/acs.chemmater.8b04412","powder diffraction","","0.4066","","","1.45","","","","","","","","0.4","","","","","","","has coordinates","220493","2020-10-21","18:00:00",""
"4003075","12.80484","0.00004","4.04053","0.000012","5.51174","0.00002","90","","100.988","0.0003","90","","279.94","0.0016","100","","100","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","NiBi2","- Bi2 Ni -","- Bi2 Ni -","- Bi8 Ni4 -","4","0.5","","Clarke, Samantha M.; Powderly, Kelly M.; Walsh, James P. S.; Yu, Tony; Wang, Yanbin; Meng, Yue; Jacobsen, Steven D.; Freedman, Danna E.","Controlling Dimensionality in the Ni‒Bi System with Pressure","Chemistry of Materials","2019","31","3","955","","10.1021/acs.chemmater.8b04412","powder diffraction","","0.412717","","","1.45","","","","","","","","0.4","","","","","","","has coordinates","220494","2020-10-21","18:00:00",""
"4003076","6.3354","0.0003","19.8007","0.0009","12.5707","0.0005","90","","90.757","0.002","90","","1576.8","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","shs244m","","","- C7 H12 I4 N2 Pb -","- C7 H12 I4 N2 Pb -","- C28 H48 I16 N8 Pb4 -","4","1","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.0309","0.0298","","","0.0801","0.0806","","","","","","1.294","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003077","12.3353","0.0002","12.2206","0.0003","32.2371","0.0008","90","","94.296","0.001","90","","4845.92","0.19","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C32 H45 I8 N4 Pb2 -","- C32 H45 I8 N4 Pb2 -","- C128 H180 I32 N16 Pb8 -","4","1","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.0395","0.0388","","","0.1038","0.1045","","","","","","1.125","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003078","8.8952","0.0002","19.7237","0.0005","8.925","0.0002","90","","92.2131","0.0007","90","","1564.69","0.06","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H9 I4 N3 Pb -","- C5 H9 I4 N3 Pb -","- C20 H36 I16 N12 Pb4 -","4","1","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.031","0.03","","","0.0717","0.0721","","","","","","1.224","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003079","12.6656","0.0003","20.5236","0.0005","12.8846","0.0003","90","","94.6417","0.0007","90","","3338.29","0.14","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","je328m","","","- C14 H34 I8 N4 Pb2 -","- C14 H34 I8 N4 Pb2 -","- C56 H136 I32 N16 Pb8 -","4","1","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.0317","0.0244","","","0.053","0.0571","","","","","","1.034","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003080","12.4948","0.0003","19.7152","0.0004","12.5841","0.0003","90","","96.4396","0.0008","90","","3080.38","0.12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H11 I4 N3 Pb -","- C5 H11 I4 N3 Pb -","- C40 H88 I32 N24 Pb8 -","8","2","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.0395","0.0267","","","0.0451","0.0494","","","","","","1.097","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003081","20.6609","0.0006","8.9123","0.0003","22.7613","0.0006","90","","115.758","0.001","90","","3774.7","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C10 H24 I10 N6 O2 Pb3 -","- C10 H24 I10 N6 O2 Pb3 -","- C40 H96 I40 N24 O8 Pb12 -","4","0.5","","Febriansyah, Benny; Koh, Teck Ming; Lekina, Yulia; Jamaludin, Nur Fadilah; Bruno, Annalisa; Ganguly, Rakesh; Shen, Ze Xiang; Mhaisalkar, Subodh G.; England, Jason","Improved Photovoltaic Efficiency and Amplified Photocurrent Generation in Mesoporous n = 1 Two-Dimensional Lead‒Iodide Perovskite Solar Cells","Chemistry of Materials","2019","31","3","890","","10.1021/acs.chemmater.8b04064","","","0.71073","MoKα","","0.0263","0.0221","","","0.0422","0.0437","","","","","","1.111","","","","has coordinates","220495","2020-10-21","18:00:00",""
"4003082","10.86215","0.00015","11.41095","0.00011","17.09812","0.00016","84.6203","0.0005","75.4586","0.0008","84.3682","0.0009","2036.22","0.04","298","","298","","","","","","","","see text","6","P -1","-P 1","2","","","","- C42 H35 Eu N6 O8 S2 -","- C42 H35 Eu N6 O8 S2 -","- C84 H70 Eu2 N12 O16 S4 -","2","1","","Kovalenko, Anton; Rublev, Pavel O.; Tcelykh, Lyubov O.; Goloveshkin, Alexander S.; Lepnev, Leonid S.; Burlov, Anatolii S.; Vashchenko, Andrey A.; Marciniak, Łukasz; Magerramov, Abel M.; Shikhaliyev, Namig G.; Vatsadze, Sergey Z.; Utochnikova, Valentina V.","Lanthanide Complexes with 2-(Tosylamino)-benzylidene-N-(aryloyl)hydrazones: Universal Luminescent Materials","Chemistry of Materials","2019","31","3","759","","10.1021/acs.chemmater.8b03675","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","","0.0032","1.627","","","","","","","has coordinates","301811","2025-08-19","19:33:37",""
"4003083","16.876","0.003","13.357","0.0019","19.197","0.003","90","","108.49","0.003","90","","4103.9","1.1","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 N8 O6.5 S2 Yb -","- C41 H36 N8 O6.5 S2 Yb -","- C164 H144 N32 O26 S8 Yb4 -","4","1","","Kovalenko, Anton; Rublev, Pavel O.; Tcelykh, Lyubov O.; Goloveshkin, Alexander S.; Lepnev, Leonid S.; Burlov, Anatolii S.; Vashchenko, Andrey A.; Marciniak, Łukasz; Magerramov, Abel M.; Shikhaliyev, Namig G.; Vatsadze, Sergey Z.; Utochnikova, Valentina V.","Lanthanide Complexes with 2-(Tosylamino)-benzylidene-N-(aryloyl)hydrazones: Universal Luminescent Materials","Chemistry of Materials","2019","31","3","759","","10.1021/acs.chemmater.8b03675","","","0.71073","MoKα","","0.1273","0.0583","","","0.119","0.1441","","","","","","1.012","","","","has coordinates","220497","2020-10-21","18:00:00",""
"4003140","5.5672","0.0001","8.2191","0.0002","4.7841","0.0001","90","","90","","90","","218.908","0.008","224","8","224","8","","","","","","","","5","P m n 21","P 2ac -2","31","","","","- H2 K Mg O5 P -","- H2 K Mg O5 P -","- H4 K2 Mg2 O10 P2 -","2","0.5","","Bai, Zhiyong; Hu, Chun-Li; Liu, Lehui; Zhang, Lizhen; Huang, Yisheng; Yuan, Feifei; Lin, Zhoubin","KMg(H2O)PO4: A Deep-Ultraviolet Transparent Nonlinear Optical Material Derived from KTiOPO4","Chemistry of Materials","2019","31","22","9540","","10.1021/acs.chemmater.9b03950","","x-ray","1.3405","GaKα","","0.0184","0.0183","","","0.0459","0.046","","","","","","1.019","","","","has coordinates","246545","2020-10-21","18:00:00",""
"4003405","12.9918","0.0005","24.4505","0.0009","22.1009","0.0009","90","","91.4855","0.0011","90","","7018.1","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 F4 Ir N8 O0.5 -","- C36 H36 F4 Ir N8 O0.5 -","- C288 H288 F32 Ir8 N64 O4 -","8","2","","Chen, Yi-Kuang; Kuo, Hsin-Hung; Luo, Dian; Lai, Yi-Ning; Li, Wei-Cheng; Chang, Chih-Hao; Escudero, Daniel; Jen, Alex K.-Y.; Hsu, Ling-Yang; Chi, Yun","Phenyl- and Pyrazolyl-Functionalized Pyrimidine: Versatile Chromophore of Bis-Tridentate Ir(III) Phosphors for Organic Light-Emitting Diodes","Chemistry of Materials","2018","31","17","6453","","10.1021/acs.chemmater.8b04278","","","0.71073","MoKα","","0.0367","0.0254","","","0.0505","0.0552","","","","","","1.049","","","","has coordinates,has disorder","302841","2025-10-09","10:00:56",""
"4003406","12.3992","0.0004","17.092","0.0005","17.1949","0.0005","90","","109.516","0.0008","90","","3434.71","0.18","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H35 F4 Ir N8 -","- C36 H35 F4 Ir N8 -","- C144 H140 F16 Ir4 N32 -","4","1","","Chen, Yi-Kuang; Kuo, Hsin-Hung; Luo, Dian; Lai, Yi-Ning; Li, Wei-Cheng; Chang, Chih-Hao; Escudero, Daniel; Jen, Alex K.-Y.; Hsu, Ling-Yang; Chi, Yun","Phenyl- and Pyrazolyl-Functionalized Pyrimidine: Versatile Chromophore of Bis-Tridentate Ir(III) Phosphors for Organic Light-Emitting Diodes","Chemistry of Materials","2018","31","17","6453","","10.1021/acs.chemmater.8b04278","","","0.71073","MoKα","","0.0318","0.0243","","","0.0504","0.0542","","","","","","1.082","","","","has coordinates,has disorder","231580","2020-10-21","18:00:00",""
"4003436","10.7797","0.0004","10.8247","0.0004","13.9842","0.0005","95.93","0.003","111.005","0.002","104.877","0.002","1437.36","0.1","170","2","170","2","","","","","","","","3","P -1","-P 1","2","","","","- C39 H28 N3 -","- C39 H28 N3 -","- C78 H56 N6 -","2","1","","Hu, Xiaoguang; Chen, Hanjiao; Zhao, Lei; Miao, Maosheng; Zheng, Yonghao","Observation of a Solid-State-Induced Thermally Populated Spin-Triplet State in Radical Regioisomers","Chemistry of Materials","2019","31","24","10256","","10.1021/acs.chemmater.9b04495","","","1.54178","CuKα","","0.0722","0.0458","","","0.1146","0.1337","","","","","","1.007","","","","has coordinates","246544","2020-10-21","18:00:00",""
"4003437","10.8315","0.0006","10.9695","0.0005","14.0301","0.0006","96.526","0.004","110.256","0.003","105.326","0.004","1469","0.14","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C39 H28 N3 -","- C39 H28 N3 -","- C78 H56 N6 -","2","1","","Hu, Xiaoguang; Chen, Hanjiao; Zhao, Lei; Miao, Maosheng; Zheng, Yonghao","Observation of a Solid-State-Induced Thermally Populated Spin-Triplet State in Radical Regioisomers","Chemistry of Materials","2019","31","24","10256","","10.1021/acs.chemmater.9b04495","","","1.54178","CuKα","","0.1012","0.0541","","","0.1264","0.1539","","","","","","0.92","","","","has coordinates","246544","2020-10-21","18:00:00",""
"4003438","9.7905","0.0004","9.3048","0.0006","16.1235","0.0007","90","","96.838","0.004","90","","1458.38","0.13","143","0.1","143","0.1","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C39 H28 N3 -","- C39 H28 N3 -","- C78 H56 N6 -","2","1","","Hu, Xiaoguang; Chen, Hanjiao; Zhao, Lei; Miao, Maosheng; Zheng, Yonghao","Observation of a Solid-State-Induced Thermally Populated Spin-Triplet State in Radical Regioisomers","Chemistry of Materials","2019","31","24","10256","","10.1021/acs.chemmater.9b04495","","x-ray","0.71073","MoKα","","0.0712","0.0461","","","0.0789","0.0877","","","","","","1.009","","","","has coordinates","246544","2020-10-21","18:00:00",""
"4003439","9.7865","0.0003","9.3003","0.0003","16.1043","0.0004","90","","96.748","0.003","90","","1455.62","0.07","292.5","0.4","292.5","0.4","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C39 H28 N3 -","- C39 H28 N3 -","- C78 H56 N6 -","2","1","","Hu, Xiaoguang; Chen, Hanjiao; Zhao, Lei; Miao, Maosheng; Zheng, Yonghao","Observation of a Solid-State-Induced Thermally Populated Spin-Triplet State in Radical Regioisomers","Chemistry of Materials","2019","31","24","10256","","10.1021/acs.chemmater.9b04495","","x-ray","1.54184","CuKα","","0.0575","0.0522","","","0.1389","0.1478","","","","","","1.039","","","","has coordinates","246544","2020-10-21","18:00:00",""
"4003440","9.6751","0.0003","19.2046","0.0007","15.8341","0.0005","90","","92.7","0.003","90","","2938.81","0.17","296.3","0.9","296.3","0.9","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C39 H28 N3 -","- C39 H28 N3 -","- C156 H112 N12 -","4","1","","Hu, Xiaoguang; Chen, Hanjiao; Zhao, Lei; Miao, Maosheng; Zheng, Yonghao","Observation of a Solid-State-Induced Thermally Populated Spin-Triplet State in Radical Regioisomers","Chemistry of Materials","2019","31","24","10256","","10.1021/acs.chemmater.9b04495","","x-ray","1.54184","CuKα","","0.061","0.0518","","","0.1449","0.156","","","","","","1.016","","","","has coordinates","246544","2020-10-21","18:00:00",""
"4003449","9.7129","0.0005","3.7122","0.0002","10.9575","0.0005","90","","102.007","0.001","90","","386.44","0.03","293","2","293","2","","","","","","","","5","P 1 m 1","P -2y","6","","","","- F4 I K5 O12 W3 -","- F4 I K5 O12 W3 -","- F4 I K5 O12 W3 -","1","0.5","","Wu, Chao; Lin, Lin; Jiang, Xingxing; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Halasyamani, P. Shiv; Zhang, Chi","K5(W3O9F4)(IO3): An Efficient Mid-Infrared Nonlinear Optical Compound with High Laser Damage Threshold","Chemistry of Materials","2019","31","24","10100","","10.1021/acs.chemmater.9b03214","","","0.71073","MoKα","","0.0389","0.0388","","","0.1014","0.1018","","","","","","1.109","","","","has coordinates","246543","2020-10-21","18:00:00",""
"4027827","3.165","","3.165","","3.975","","90","","90","","120","","34.484","","","","","","","","","","","","","2","P 6/m m m","-P 6 2","191","","Np B2","","- B2 Np -","- B2 Np -","- B2 Np -","1","0.0416667","","Mulford, R.N.R.; Eick, H.A.","Americium and neptunium borides","Journal of Inorganic and Nuclear Chemistry","1969","31","","371","375","10.1016/0022-1902(69)80480-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030614","9.274","0.001","9.274","0.001","9.274","0.001","90","","90","","90","","797.63","0.15","","","293","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- Al N Na3 O9 P3 -","- Al N Na3 O9 P3 -","- Al4 N4 Na12 O36 P12 -","4","0.333333","","Conanec, R.; L Haridon, P.; Feldmann, W.; Marchand, R.; Laurent, Y.","Crystal structure determination of the nitridophosphate Na3AlP3O9N","European Journal of Solid State and Inorganic Chemistry","1994","31","","13","24","","","x-ray","0.71073","MoKα","","","0.0137","","","0.0199","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030615","8.7906","0.0004","8.2757","0.0005","8.5617","0.0004","90","","111.14","0.01","90","","580.93","0.06","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H6 N O5 P V -","- C2 H6 N O5 P V -","- C8 H24 N4 O20 P4 V4 -","4","1","","Riou, D.; Ferey, G","The structure of the intercalate VOPO4, 0.5 piperazin","European Journal of Solid State and Inorganic Chemistry","1994","31","","25","35","","","x-ray","0.71069","MoKα","","","0.024","","","0.025","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030616","13.81","0.008","10.983","0.001","6.395","0.001","90","","117.48","0.03","90","","860.5","0.6","","","293","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- N3 Na3 W -","- N3 Na3 W -","- N24 Na24 W8 -","8","2","","Jacobs, H.; Niewa, R.","Synthesis and crystal structure of a sodium nitrido tungstate (VI), Na3WN3","European Journal of Solid State and Inorganic Chemistry","1994","31","","105","113","","","x-ray","0.56","aGKα","","","0.051","","","0.062","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030617","4.504","0.002","8.422","0.003","6.71","0.004","90","","106.26","0.04","90","","244.3","0.2","","","293","","","","","","","","","4","A 1 2/m 1","-A 2y","12","","","","- Cu0.92 Mn1.08 O7 P2 -","- Cu0.92 Mn1.08 O7 P2 -","- Cu1.84 Mn2.16 O14 P4 -","2","0.25","","Handizi, A.; Boukhari, A.; Holt, E. M.; Aride, J.; Belaiche, M.; Drillon, M.","(Cu,M)2P2O7; M = Mn, Co : synthesis, magnetism and solid state structures of Cu0.92Mn1.08P2O7 and CuCoP2O7","European Journal of Solid State and Inorganic Chemistry","1994","31","","123","135","","","x-ray","0.71073","MoKα","","","0.065","","","0.089","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030618","6.912","0.003","6.658","0.003","6.315","0.003","109.06","0.03","132.91","0.02","38.62","0.02","118.69","0.17","","","293","","","","","","","","","4","P 1","P 1","1","","","","- Co Cu O7 P2 -","- Co Cu O7 P2 -","- Co Cu O7 P2 -","1","1","","Handizi, A.; Boukhari, A.; Holt, E. M.; Aride, J.; Belaiche, M.; Drillon, M.","(Cu,M)2P2O7; M = Mn, Co : synthesis, magnetism and solid state structures of Cu0.92Mn1.08P2O7 and CuCoP2O7","European Journal of Solid State and Inorganic Chemistry","1994","31","","123","135","","","x-ray","0.71073","MoKα","","","0.065","","","0.087","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030619","21.127","0.003","7.665","0.001","7.478","0.001","90","","90","","90","","1211","0.3","","","292","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- F15 Mn Na5 Zr2 -","- F15 Mn Na5 Zr2 -","- F60 Mn4 Na20 Zr8 -","4","0.25","","Kettani, M. H.; Avignant, D.; Metin, J.","Crystal structure of Na5MnZr2F15","European Journal of Solid State and Inorganic Chemistry","1994","31","","137","149","","","x-ray","0.71069","MoKα","","","0.031","","","0.034","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030620","10.445","0.001","10.445","0.001","10.445","0.001","90","","90","","90","","1139.53","0.19","","","298","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- O12 P2 Pb4 S -","- O12 P2.001 Pb4 S0.999 -","- O48 P8.004 Pb16 S3.996 -","4","0.0833333","","Barbier, J.","Refinement of the eulytite-type Pb4(PO4)2SO4 structure","European Journal of Solid State and Inorganic Chemistry","1994","31","","163","171","","","x-ray","0.56087","AgKα","","","0.038","","","","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030621","10.4715","0.0004","10.4715","0.0004","10.4715","0.0004","90","","90","","90","","1148.22","0.08","","","298","","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- O12 P2 Pb4 S -","- O12 P2.001 Pb4 S0.999 -","- O48 P8.004 Pb16 S3.996 -","4","0.0833333","","Barbier, J.","Refinement of the eulytite-type Pb4(PO4)2SO4 structure","European Journal of Solid State and Inorganic Chemistry","1994","31","","163","171","","powder diffraction","neutron","1.3919","","","","","","","","","","0.073","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030622","23.362","0.001","7.3127","0.0006","8.236","0.001","90","","90","","90","","1407","0.2","","","293","","","","","","","","","5","C m c m","-C 2c 2","63","","","","- F19 H2 La O Th4 -","- F19 La O Th4 -","- F76 La4 O4 Th16 -","4","0.25","","Guery, J.; Gao, Y.; Guery, C.; Jacoboni, C.","Crystal structure of LaTh4F19.H2O","European Journal of Solid State and Inorganic Chemistry","1994","31","","187","196","","","x-ray","0.71069","MoKα","","","0.0398","","","0.0385","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030623","5.5402","0.0006","5.5402","0.0006","8.453","0.001","90","","90","","90","","259.45","0.05","","","293","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Cr F6 Nb -","- Cr F6 Nb -","- Cr2 F12 Nb2 -","2","0.0625","","Goubard, F.; Chassaing, J.; Bizot, D.; Quarton, M.","Synthesis, structural and spectroscopic studies of CrIINbIVF6","European Journal of Solid State and Inorganic Chemistry","1994","31","","223","233","","powder diffraction","x-ray","1.54178","CuKα","","","","","","","","","0.072","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030644","5.958","0.002","5.958","0.002","18.045","0.003","90","","90","","120","","554.7","0.3","","","293","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Ba5 O10 Ru2 -","- Ba5 O10 Ru2 -","- Ba10 O20 Ru4 -","2","0.0833333","","Dussarrat, C.; Fompeyrine, J.; Darriet, J.","Ba5Ru2O10 : A new structural model resulting from the stacking of [BaO3] and [Ba2O] mixed layers. Structural relationships to the hexagonal perovskite-type structures","European Journal of Solid State and Inorganic Chemistry","1994","31","","289","300","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0476","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030645","6.4627","0.0009","7.42","0.001","8.891","0.001","77.821","0.007","84.542","0.006","67.34","0.01","384.54","0.09","","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C6 H16 Cl4 N2 O4 Pd -","- C6 H16 Cl4 N2 O4 Pd -","- C6 H16 Cl4 N2 O4 Pd -","1","0.5","","Laligant, Y.; Laligant, A.; Emery, J.; Buzare, J. Y.","Complexe of tetrachloro palladium (II) with alanine : synthesis, crystal structure and solid state NMR study of (H-alanine)2(PdCl4)","European Journal of Solid State and Inorganic Chemistry","1994","31","","325","335","","","x-ray","0.71069","MoKα","","","0.0456","","","0.1192","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030646","6.726","0.002","6.915","0.002","13.494","0.004","78.38","0.02","83.09","0.02","71.79","0.02","582.8","0.3","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C6 H14 Cl4 N2 Pd -","- C6 H14 Cl4 N2 Pd -","- C12 H28 Cl8 N4 Pd2 -","2","1","","Laligant, Y.; Laligant, A.","Chloro complexe of palladium with 1,4-diazabicyclo [2.2.2] octane : crystal structure of (C6N2H14)[PdCl4]","European Journal of Solid State and Inorganic Chemistry","1994","31","","401","408","","","x-ray","0.71069","MoKα","","","0.022","","","0.024","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030656","10.202","0.005","10.202","0.005","10.202","0.005","90","","90","","90","","1061.8","0.9","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi24 O40 Ti2 -","- Bi24 O40 Ti2 -","- Bi24 O40 Ti2 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0781","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030657","10.199","0.001","10.199","0.001","10.199","0.001","90","","90","","90","","1060.9","0.18","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi16.3 Co8.9 O40 -","- Bi16.32 Co8.9 O40 -","- Bi16.32 Co8.9 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.1125","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030658","10.19","0.001","10.19","0.001","10.19","0.001","90","","90","","90","","1058.09","0.18","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi12.2 Co12.8 O40 -","- Bi12.24 Co12.8 O40 -","- Bi12.24 Co12.8 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.1351","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030659","10.138","0.002","10.138","0.002","10.138","0.002","90","","90","","90","","1042","0.4","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi10.1 Co15.9 O40 -","- Bi10.08 Co15.92 O40 -","- Bi10.08 Co15.92 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.1866","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030660","10.23","0.007","10.23","0.007","10.23","0.007","90","","90","","90","","1070.6","1.3","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi24 Mn2 O40 -","- Bi24 Mn2 O40 -","- Bi24 Mn2 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.109","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030661","10.21","0.005","10.21","0.005","10.21","0.005","90","","90","","90","","1064.3","0.9","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi25 Fe O40 -","- Bi25.04 Fe0.84 O40 -","- Bi25.04 Fe0.84 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0816","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030662","10.292","0.008","10.292","0.008","10.292","0.008","90","","90","","90","","1090.2","1.5","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi24 O40 Pb2 -","- Bi24 O40 Pb2 -","- Bi24 O40 Pb2 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.1035","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030663","10.141","0.007","10.141","0.007","10.141","0.007","90","","90","","90","","1042.9","1.2","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi19.6 Ni6.4 O40 -","- Bi19.68 Ni6.32 O40 -","- Bi19.68 Ni6.32 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0957","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030664","10.215","0.001","10.215","0.001","10.215","0.001","90","","90","","90","","1065.9","0.18","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi25 Co O40 -","- Bi24.96 Co O40 -","- Bi24.96 Co O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0503","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030665","10.217","0.001","10.217","0.001","10.217","0.001","90","","90","","90","","1066.52","0.18","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi23.6 Co1.8 O40 -","- Bi23.52 Co1.8 O40 -","- Bi23.52 Co1.8 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0826","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030666","10.21","0.001","10.21","0.001","10.21","0.001","90","","90","","90","","1064.33","0.18","","","293","","","","","","","","","3","I 2 3","I 2 2 3","197","","","","- Bi19.7 Co6.2 O40 -","- Bi19.68 Co6.2 O40 -","- Bi19.68 Co6.2 O40 -","1","0.0416667","","Rangavittal, N; Guru Row, T. N.; Rao, C. N. R.","A study of cubic bismuth oxides of the type Bi(26-x)MxO(40-delta) (M = Ti, Mn, Fe, Co, Ni or Pb) related to gamma-Bi2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","409","422","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.1001","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030667","5.2718","0.0001","5.2718","0.0001","5.2718","0.0001","90","","90","","90","","146.513","0.005","","","293","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- F6 H4 N Ta -","- F6 H3.996 N0.998 Ta0.998 -","- F6 H3.996 N0.998 Ta0.998 -","1","0.0208333","","Crimberg, C.; Strahle, J.; Laval, J.-P.; Frit, B.; Sonntag, R.; Ihringer, J.","X-ray and neutron-diffraction study of NH4TaF6","European Journal of Solid State and Inorganic Chemistry","1994","31","","449","462","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.0686","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030668","5.12","0.01","5.12","0.01","5.12","0.01","96.23","0.01","96.23","0.01","96.23","0.01","131.7","0.4","","","200","","","","","","","","","4","R -3 :R","-P 3*","148","","","","- F6 H4 N Ta -","- F6 H4 N Ta -","- F6 H4 N Ta -","1","0.166667","","Crimberg, C.; Strahle, J.; Laval, J.-P.; Frit, B.; Sonntag, R.; Ihringer, J.","X-ray and neutron-diffraction study of NH4TaF6","European Journal of Solid State and Inorganic Chemistry","1994","31","","449","462","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.075","","","","","","","","has coordinates","189075","2020-10-21","18:00:00",""
"4030676","14.4963","0.0001","14.4963","0.0001","9.3193","0.0001","90","","90","","90","","1958.38","0.03","","","293","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","","","- Bi2 Cd O4 -","- Bi2 Cd O4 -","- Bi32 Cd16 O64 -","16","0.5","","Champarnaud-mesjard, J.-C.; Frit, B.; Aftati, A.; El Farissi, M.","Crystal structure of Bi2CdO4","European Journal of Solid State and Inorganic Chemistry","1994","31","","473","486","","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.051","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030677","12.982","0.004","11.191","0.001","27.681","0.008","90","","90","","90","","4021.5","1.7","","","293","","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C8 H4 F12 O10 Rh2 -","- C8 F12 O10 Rh2 -","- C64 F96 O80 Rh16 -","8","1","","Cotton, F. A.; Kim, Y.","Three Rh2(O2CCF3)4L2 compounds, with L = H2O, tetrahydrofuran and acetonitrile","European Journal of Solid State and Inorganic Chemistry","1994","31","","525","534","","","x-ray","0.71073","MoKα","","","0.07","","","0.08","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030678","9.403","0.003","9.852","0.002","8.692","0.001","107.35","0.01","106.82","0.01","62.04","0.02","668.1","0.3","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 F12 O10 Rh2 -","- C16 F12 O10 Rh2 -","- C16 F12 O10 Rh2 -","1","0.5","","Cotton, F. A.; Kim, Y.","Three Rh2(O2CCF3)4L2 compounds, with L = H2O, tetrahydrofuran and acetonitrile","European Journal of Solid State and Inorganic Chemistry","1994","31","","525","534","","","x-ray","1.54184","CuKα","","","0.059","","","0.077","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030679","8.872","0.003","8.374","0.001","15.26","0.003","90","","100.41","0.02","90","","1115.1","0.5","","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 F12 N2 O8 Rh2 -","- C12 F12 N2 O8 Rh2 -","- C24 F24 N4 O16 Rh4 -","2","0.5","","Cotton, F. A.; Kim, Y.","Three Rh2(O2CCF3)4L2 compounds, with L = H2O, tetrahydrofuran and acetonitrile","European Journal of Solid State and Inorganic Chemistry","1994","31","","525","534","","","x-ray","0.71073","MoKα","","","0.032","","","0.038","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030680","12.682","0.003","9.428","0.002","17.105","0.003","90","","108.67","0.02","90","","1937.6","0.7","","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H42 Cr2 N6 O14 S2 -","- C30 H42 Cr2 N6 O14 S2 -","- C60 H84 Cr4 N12 O28 S4 -","2","0.5","","Cotton, F. A.; Daniels, L. M.; Murillo, C. A.; Zuniga, L. A.","The aqueous chromium sulfate-pyridine system: X-ray structural characterization of chain- and tetranuclear compounds","European Journal of Solid State and Inorganic Chemistry","1994","31","","535","544","","","x-ray","0.71073","MoKα","","","0.034","","","0.046","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030681","13.702","0.001","13.702","0.001","14.192","0.001","90","","90","","90","","2664.5","0.3","","","295","","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C40 H48 Cr4 N8 O22 S4 -","- C40 H48 Cr4 N8 O22 S4 -","- C80 H96 Cr8 N16 O44 S8 -","2","0.25","","Cotton, F. A.; Daniels, L. M.; Murillo, C. A.; Zuniga, L. A.","The aqueous chromium sulfate-pyridine system: X-ray structural characterization of chain- and tetranuclear compounds","European Journal of Solid State and Inorganic Chemistry","1994","31","","535","544","","","x-ray","1.54184","CuKα","","","0.038","","","0.047","","","","","","","","","","","has coordinates","301828","2025-08-20","10:28:59",""
"4030682","11.684","0.001","26.367","0.003","10.535","0.001","90","","114.08","0.03","90","","2963.1","0.9","","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H88 N6 O36 V10 -","- C24 N6 O36 V10 -","- C48 N12 O72 V20 -","2","0.5","","Averbuch-Pouchot, M.-T.","Tert-butylammonium condensed vanadates. I. Hexakis(tert-butylammonium decavanadate octahydrate)","European Journal of Solid State and Inorganic Chemistry","1994","31","","557","565","","","x-ray","0.5608","AgKα","","","0.038","","","0.042","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030684","14.988","0.003","14.988","0.003","7.371","0.002","90","","90","","90","","1655.8","0.6","","","294","","","","","","","","","5","I 4/m","-I 4","87","","","","- C16 H48 N4 O12 V4 -","- C16 H40 N4 O12 V4 -","- C32 H80 N8 O24 V8 -","2","0.125","","Averbuch-Pouchot, M.-T.; Durif, A.","Tert-butylammonium condensed vanadates. II. Tert-butylammonium cyclotetravanadate","European Journal of Solid State and Inorganic Chemistry","1994","31","","567","573","","","x-ray","0.5608","AgKα","","","0.04","","","0.044","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030685","8.672","0.001","10.1867","0.0007","16.788","0.002","90","","93.12","0.02","90","","1480.8","0.3","","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C2 H14 F2 Ga3 N2 O13 P3 -","- C2 H12 F2 Ga3 N2 O13 P3 -","- C8 H48 F8 Ga12 N8 O52 P12 -","4","1","","Cavellec, M.; Riou, D.; Ferey, G.","Oxyfluorinated microporous compounds: VI. Synthesis and crystal structure of ULM-4: a new type of fluorinated gallophosphate with encapsulated methylamine","European Journal of Solid State and Inorganic Chemistry","1994","31","","583","594","","","x-ray","0.71073","MoKα","","","0.023","","","0.063","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030686","10.163","0.002","21.989","0.005","17.279","0.003","90","","90","","90","","3861.4","1.3","","","293","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C6 H22 F2 Ga3 N4 O13 P3 -","- C6 H19 F2 Ga3 N4 O13 P3 -","- C48 H152 F16 Ga24 N32 O104 P24 -","8","1","","Serpaggi, F.; Loiseau, T.; Riou, D.; Ferey, G.; Hosseini, M. W.","Oxyfluorinated microporous compounds: IX. Synthesis and crystal structure of ULM-8: a new layered fluorinated gallophosphate Ga3(PO4)2(HPO4)(H2O)F2,(N4C6H19)","European Journal of Solid State and Inorganic Chemistry","1994","31","","595","604","","","x-ray","0.71069","MoK1a","","","0.049","","","0.148","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030687","5.1125","0.0005","6.345","0.0006","8.981","0.001","77.04","0.006","79.624","0.007","89.711","0.005","279.08","0.05","","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C2 H6 F Ga N O4 P -","- C2 H6 F Ga N O4 P -","- C4 H12 F2 Ga2 N2 O8 P2 -","2","1","","Riou, D.; Ferey, G.","Oxyfluorinated microporous compounds: X. Synthesis and crystal structure of ULM-9: the new layered fluorinated gallophosphate GaF(PO4), 0.5 piperazine","European Journal of Solid State and Inorganic Chemistry","1994","31","","605","613","","","x-ray","0.71069","MoKα","","","0.03","","","0.079","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030698","5.527","0.007","12.214","0.003","14.003","0.003","90","","92.95","0.02","90","","944","1.2","","","296","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- Bi3 Cr2 H O11 -","- Bi3 Cr2 O11 -","- Bi12 Cr8 O44 -","4","1","","Kodialam, S.; Kumada, N.; Mackay, R.; Sleight, A. W.","Crystal structure of a new hydrogen bismuth chromate: HBi3(CrO4)2O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","739","746","","","x-ray","0.71073","MoKα","","","0.041","","","0.048","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030699","4.184","0.004","4.184","0.004","4.184","0.004","90","","90","","90","","73.24","0.12","","","293","","","","10","","","","","3","P m -3 m","-P 4 2 3","221","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K0.998 Mn0.998 -","- F3 K0.998 Mn0.998 -","1","0.0208333","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0355","","","","","","","","","","","","","","","has coordinates","178485","2020-10-21","18:00:00",""
"4030700","4.155","0.004","4.155","0.004","4.155","0.004","90","","90","","90","","71.73","0.12","","","293","","","","2200","","","","","3","P m -3 m","-P 4 2 3","221","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K0.998 Mn0.998 -","- F3 K0.998 Mn0.998 -","1","0.0208333","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0698","","","","","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030701","4.131","0.001","4.131","0.001","4.131","0.001","90","","90","","90","","70.5","0.03","","","293","","","","3000","","","","","3","P m -3 m","-P 4 2 3","221","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K0.998 Mn0.998 -","- F3 K0.998 Mn0.998 -","1","0.0208333","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0356","","","","","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030702","5.817","0.001","5.817","0.001","8.256","0.002","90","","90","","90","","279.36","0.1","","","293","","","","4250","","","","","3","I 4/m c m","-I 4 2c","140","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K Mn -","- F12 K4 Mn4 -","4","0.125","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0519","","","","","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030703","5.784","0.001","5.784","0.001","8.236","0.002","90","","90","","90","","275.53","0.09","","","293","","","","5400","","","","","3","I 4/m c m","-I 4 2c","140","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K Mn -","- F12 K4 Mn4 -","4","0.125","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0704","","","","","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030704","5.742","0.001","5.742","0.001","8.223","0.002","90","","90","","90","","271.12","0.09","","","293","","","","6900","","","","","3","I 4/m c m","-I 4 2c","140","","Potassium manganese fluoride","","- F3 K Mn -","- F3 K Mn -","- F12 K4 Mn4 -","4","0.125","","Asbrink, S; Waskowska, A","High-pressure crystal structures of K Mn F3 below and above the phase transition at Pc=3.1GPa","European Journal of Solid State Inorganic Chemistry","1994","31","","747","755","","","x-ray","0.71073","MoKα","","0.0464","","","","","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030705","5.707","0.002","5.707","0.002","13.31","0.006","90","","90","","120","","375.4","0.3","","","293","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Al0.61 O11 Sr V5.39 -","- Al0.61 O11 Sr V5.39 -","- Al1.22 O22 Sr2 V10.78 -","2","0.0833333","","Norrestam, R.; Nygren, M.; Wen, T. L.","Crystal structure and electrical properties of SrAl0.61V5.39O11","European Journal of Solid State and Inorganic Chemistry","1994","31","","793","803","","","x-ray","0.71069","MoKα","","","0.027","","","0.034","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030706","10.584","0.00006","10.584","0.00006","3.72776","0.00003","90","","90","","120","","361.641","0.004","","","293","","","","","","","","","3","P 63/m","-P 6c","176","","","","- H1.1 Mo O3.55 -","- Mo0.876 O3.104 -","- Mo5.256 O18.624 -","6","0.5","","Guo, Jingdong; Zavalij, P.; Whittingham, M. S.","Preparation and characterization of a MoO3 with hexagonal structure","European Journal of Solid State and Inorganic Chemistry","1994","31","","833","842","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.039","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030709","12.8561","0.0009","6.3528","0.0004","10.6574","0.0008","90","","90","","90","","870.41","0.1","","","843","","","","","","","","","4","P n a n","-P 2n 2bc","52","","","","- Na O5 Sb Si -","- Na O5 Sb Si -","- Na8 O40 Sb8 Si8 -","8","1","","Favard, J.-F.; Verbaere, A.; Piffard, Y.; Tournoux, M.","Phase transitions in the compounds ASbOSiO4 (A = Na, K) and ASbOGeO4 (A = K, Rb). 1. Crystal structures of the paraelectric phases","European Journal of Solid State and Inorganic Chemistry","1994","31","","995","1008","","","x-ray","0.71073","MoKα","","","0.041","","","0.046","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030710","13.035","0.003","6.503","0.001","10.609","0.002","90","","90","","90","","899.3","0.3","","","673","","","","","","","","","4","P n a n","-P 2n 2bc","52","","","","- K O5 Sb Si -","- K O5 Sb Si -","- K8 O40 Sb8 Si8 -","8","1","","Favard, J.-F.; Verbaere, A.; Piffard, Y.; Tournoux, M.","Phase transitions in the compounds ASbOSiO4 (A = Na, K) and ASbOGeO4 (A = K, Rb). 1. Crystal structures of the paraelectric phases","European Journal of Solid State and Inorganic Chemistry","1994","31","","995","1008","","","x-ray","0.71073","MoKα","","","0.035","","","0.044","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030711","13.273","0.002","6.633","0.001","10.74","0.002","90","","90","","90","","945.5","0.3","","","673","","","","","","","","","4","P n a n","-P 2n 2bc","52","","","","- Ge K O5 Sb -","- Ge K O5 Sb -","- Ge8 K8 O40 Sb8 -","8","1","","Favard, J.-F.; Verbaere, A.; Piffard, Y.; Tournoux, M.","Phase transitions in the compounds ASbOSiO4 (A = Na, K) and ASbOGeO4 (A = K, Rb). 1. Crystal structures of the paraelectric phases","European Journal of Solid State and Inorganic Chemistry","1994","31","","995","1008","","","x-ray","0.71073","MoKα","","","0.032","","","0.04","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030712","13.432","0.004","6.712","0.002","10.702","0.003","90","","90","","90","","964.8","0.5","","","523","","","","","","","","","4","P n a n","-P 2n 2bc","52","","","","- Ge O5 Rb Sb -","- Ge O5 Rb Sb -","- Ge8 O40 Rb8 Sb8 -","8","1","","Favard, J.-F.; Verbaere, A.; Piffard, Y.; Tournoux, M.","Phase transitions in the compounds ASbOSiO4 (A = Na, K) and ASbOGeO4 (A = K, Rb). 1. Crystal structures of the paraelectric phases","European Journal of Solid State and Inorganic Chemistry","1994","31","","995","1008","","","x-ray","0.71073","MoKα","","","0.036","","","0.04","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030713","6.6239","0.0009","6.901","0.001","12.539","0.002","90","","98.98","0.01","90","","566.15","0.15","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Br3 Nb Se -","- Br3 Nb Se -","- Br12 Nb4 Se4 -","4","1","","Meerschaut, A.; Grenouilleau, P.; Guemas, L.","Preparation and structure determination of NbSeBr3","European Journal of Solid State and Inorganic Chemistry","1994","31","","1029","1036","","","x-ray","0.71073","MoKα","","","0.066","","","0.081","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4030714","9.086","0.002","9.086","0.002","52.4","0.02","90","","90","","90","","4326","2","","","295","","","","","","","","","4","I 41 2 2","I 4bw 2bw","98","","","","- Cl13 Nb6 O3 Sc -","- Cl13 Nb6 O3 Se -","- Cl104 Nb48 O24 Se8 -","8","0.5","","Cordier, S.; Perrin, C.; Sergent, M.","Structure of the first ternary oxohalide with the Nb6 cluster: ScNb6Cl13O3","European Journal of Solid State and Inorganic Chemistry","1994","31","","1049","1060","","","x-ray","0.71073","MoKα","","","0.03","","","0.04","","","","","","","","","","","has coordinates","178486","2020-10-21","18:00:00",""
"4031203","3.799","","3.799","","6.16","","90","","90","","120","","76.993","","","","","","","","","","","","","3","P 3 m 1","P 3 -2""","156","","(Cu2 Hf P2)0.5","","- Cu Hf P -","- Cu Hf P -","- Cu Hf P -","1","0.166667","","Lomnitskaya, Ya.F.","The crystal structures of Zr Cu2 P2 and Hf Cu2 P2","Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii)","1986","31","","40","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031692","6.32","","6.32","","6.32","","90","","90","","90","","252.436","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Sn Te -","- Sn Te -","- Sn4 Te4 -","4","0.0208333","","Ashirov, A.; Gurshumov, A.P.; Dovletov, K.; Mamedov, N.A.","The Sn Te - In Se and Sn Te - Tl2 Se systems","Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii)","1986","31","","729","731","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4031773","5.256","","5.256","","16.95","","90","","90","","120","","405.519","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Fe2 Sc D2.91","","- D2.91 Fe2 Sc -","- D2.91 Fe2 Sc -","- D23.28 Fe16 Sc8 -","8","0.333333","","Yartys', V.A.; Burnasheva, V.V.; Fykin, L.E.; Fadeeva, N.V.; Sarin, V.A.; Semenenko, K.N.","The crystal and magnetic structure of the deuteride Sc Fe2 D2.9","Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii)","1986","31","","175","179","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031808","7.025","","7.025","","7.025","","90","","90","","90","","346.688","","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","","","","- Mg Te2 -","- Mg Te2 -","- Mg4 Te8 -","4","0.166667","","Yanagisawa, S.; Tashiro, M.; Anzai, S.","Crystal Structure of Magnesium Ditelluride","Journal of Inorganic and Nuclear Chemistry","1969","31","","943","946","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4032152","12.812","0.013","14.447","0.021","7.456","0.012","90","","90","","90","","1380","3","","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- O20 P4 Ti5 -","- O20 P4 Ti5 -","- O80 P16 Ti20 -","4","1","","Reinauer, F.; Glaum, R.; Gruehn, R.","Preparation and chemical vapour transport of mixed valent titanium(III, IV)-phosphates. With a note on the crystal structure of titanium(IV)-orthophosphate Ti~5~P~4~O~20~","European Journal of Solid State and Inorganic Chemistry","1994","31","","779","791","","","x-ray","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","190906","2020-10-21","18:00:00",""
"4067783","9.1287","0.0001","9.1287","0.0001","35.7743","0.0003","90","","90","","90","","2981.19","0.05","180","2","180","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C26 H52 Mn2 P4 -","- C26 H52 Mn2 P4 -","- C104 H208 Mn8 P16 -","4","0.5","","Stokes, Francesca A.; Less, Robert J.; Haywood, Joanna; Melen, Rebecca L.; Thompson, Richard I.; Wheatley, Andrew E. H.; Wright, Dominic S.; Johansson, Adam Johannes; Kloo, Lars","Structure and Bonding of the Manganese(II) Phosphide Complex (t-BuPH2)(η5-Cp)Mn{μ-(t-BuPH)}2Mn(Cp)(t-BuPH2)","Organometallics","2012","31","1","23","","10.1021/om200381p","","","0.71073","MoKα","","0.0188","0.0186","","","0.0545","0.0546","","","","","","1.242","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067784","16.8995","0.0004","9.7167","0.0003","20.6494","0.0005","90","","90.286","0.002","90","","3390.74","0.16","180","2","180","2","","","","","","","synthesis as described","4","I 1 2/a 1","-I 2ya","15","","","","- C23 H12 Fe S2 -","- C23 H12 Fe S2 -","- C184 H96 Fe8 S16 -","8","1","","Rose-Munch, Françoise; Li, Ming; Rose, Eric; Daran, Jean Claude; Bossi, Alberto; Licandro, Emanuela; Mussini, Patrizia Romana","Tetrathia[7]helicene-Based Complexes of Ferrocene and (η5-Cyclohexadienyl)tricarbonylmanganese: Synthesis and Electrochemical Studies","Organometallics","2012","31","1","92","","10.1021/om200571a","","","0.71073","MoKα","","0.0703","0.0367","","","0.1004","0.1177","","","","","","1.017","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067785","6.8179","0.0001","12.9134","0.0002","14.4381","0.0002","88.678","0.001","77.306","0.001","85.367","0.001","1236.02","0.03","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C23.5 H24 Cl3 N O3 Pt S -","- C23.5 H24 Cl3 N O3 Pt S -","- C47 H48 Cl6 N2 O6 Pt2 S2 -","2","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0398","0.0297","","","0.0736","0.0787","","","","","","1.054","","","","has coordinates,has disorder","301829","2025-08-20","12:17:39",""
"4067786","10.279","0.0001","19.69","0.0002","10.968","0.0001","90","","111.432","0.001","90","","2066.35","0.04","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N O2 Pt S -","- C24 H23 N O2 Pt S -","- C96 H92 N4 O8 Pt4 S4 -","4","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0223","0.0187","","","0.0435","0.0448","","","","","","1.086","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067787","17.8659","0.0003","17.1383","0.0002","9.7579","0.0001","90","","101.968","0.001","90","","2922.84","0.07","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 N O2 P Pt -","- C38 H30 N O2 P Pt -","- C152 H120 N4 O8 P4 Pt4 -","4","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0252","0.0165","","","0.0368","0.0375","","","","","","0.975","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067788","14.1871","0.0002","9.4268","0.0001","18.691","0.0002","90","","102.419","0.001","90","","2441.22","0.05","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Cl2 N2 O2 Pt -","- C26 H26 Cl2 N2 O2 Pt -","- C104 H104 Cl8 N8 O8 Pt4 -","4","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0313","0.0217","","","0.0412","0.0437","","","","","","1.045","","","","has coordinates,has disorder","178568","2020-10-21","18:00:00",""
"4067789","12.4337","0.0001","16.8711","0.0001","19.1912","0.0001","90","","90","","90","","4025.74","0.05","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H20 N2 O2 Pt -","- C25 H20 N2 O2 Pt -","- C200 H160 N16 O16 Pt8 -","8","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0429","0.0271","","","0.0762","0.0797","","","","","","0.993","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067790","8.6021","0.0001","12.1749","0.0003","13.2392","0.0003","115.847","0.003","104.631","0.002","90.247","0.002","1196.9","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H28 N2 O2 Pt -","- C29 H28 N2 O2 Pt -","- C58 H56 N4 O4 Pt2 -","2","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0215","0.0169","","","0.0319","0.0323","","","","","","0.958","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067791","12.3157","0.0002","12.2156","0.0002","16.2772","0.0003","90","","93.757","0.002","90","","2443.54","0.07","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 Cl2 N3 O2 Pt -","- C26 H23 Cl2 N3 O2 Pt -","- C104 H92 Cl8 N12 O8 Pt4 -","4","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.042","0.0226","","","0.0328","0.034","","","","","","0.803","","","","has coordinates,has disorder","178568","2020-10-21","18:00:00",""
"4067792","10.5452","0.0002","7.3885","0.0001","27.6064","0.0005","90","","100.074","0.002","90","","2117.74","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H19 N3 O2 Pt -","- C26 H19 N3 O2 Pt -","- C104 H76 N12 O8 Pt4 -","4","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.035","0.0301","","","0.0755","0.077","","","","","","1.016","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067793","10.528","0.0002","12.2449","0.0003","13.0739","0.0003","65.409","0.002","68.455","0.002","86.553","0.002","1416.88","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H25 Cl4 N3 O3 Pt -","- C28 H25 Cl4 N3 O3 Pt -","- C56 H50 Cl8 N6 O6 Pt2 -","2","1","","Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R.","New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties","Organometallics","2012","31","1","105","","10.1021/om200589q","","","0.71073","MoKα","","0.0315","0.022","","","0.0422","0.043","","","","","","0.947","","","","has coordinates,has disorder","178568","2020-10-21","18:00:00",""
"4067794","14.5153","0.0015","18.666","0.002","15.9805","0.0017","90","","95.93","0.002","90","","4306.6","0.8","103","2","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(T(p-OMe)PP)Ru(NO)Et","","","- C51 H43 Cl2 N5 O5 Ru -","- C51 H43 Cl2 N5 O5 Ru -","- C204 H172 Cl8 N20 O20 Ru4 -","4","1","","Xu, Nan; Lilly, John; Powell, Douglas R.; Richter-Addo, George B.","Synthesis, Characterization, and Infrared Reflectance Spectroelectrochemistry of Organoruthenium Nitrosyl Porphyrins","Organometallics","2012","31","3","827","","10.1021/om200601g","","","0.71073","MoKα","","0.0476","0.0442","","","0.1189","0.1217","","","","","","1.056","","","","has coordinates,has disorder","178568","2020-10-21","18:00:00",""
"4067795","15.6941","0.0004","15.6941","0.0004","7.2842","0.0002","90","","90","","90","","1794.13","0.08","200","2","200","2","","","","","","","","4","P 4 n c","P 4 -2n","104","","","","- C41 H41 Co O8 -","- C41 H41 Co O8 -","- C82 H82 Co2 O16 -","2","0.25","","Bertrand, Guillaume; Tortech, Ludovic; Fichou, Denis; Malacria, Max; Aubert, Corinne; Gandon, Vincent","An Improved Protocol for the Synthesis of [(η4-C4R4)Co(η5-C5H5)] Complexes","Organometallics","2012","31","1","126","","10.1021/om200662g","","","0.71073","MoKα","","0.0419","0.035","","","0.0884","0.0919","","","","","","1.146","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067796","10.7152","0.0003","11.6509","0.0004","17.0103","0.0005","79.647","0.001","71.889","0.002","89.139","0.001","1983.63","0.11","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C49 H57 Co -","- C49 H57 Co -","- C98 H114 Co2 -","2","1","","Bertrand, Guillaume; Tortech, Ludovic; Fichou, Denis; Malacria, Max; Aubert, Corinne; Gandon, Vincent","An Improved Protocol for the Synthesis of [(η4-C4R4)Co(η5-C5H5)] Complexes","Organometallics","2012","31","1","126","","10.1021/om200662g","","","0.71073","MoKα","","0.0725","0.0558","","","0.1453","0.1584","","","","","","1.024","","","","has coordinates,has disorder","178568","2020-10-21","18:00:00",""
"4067797","17.906","0.011","11.782","0.007","22.282","0.013","90","","94.45","0.04","90","","4687","5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C57 H41 Co -","- C57 H41 Co -","- C228 H164 Co4 -","4","1","","Bertrand, Guillaume; Tortech, Ludovic; Fichou, Denis; Malacria, Max; Aubert, Corinne; Gandon, Vincent","An Improved Protocol for the Synthesis of [(η4-C4R4)Co(η5-C5H5)] Complexes","Organometallics","2012","31","1","126","","10.1021/om200662g","","","0.71073","MoKα","","0.0908","0.063","","","0.1937","0.226","","","","","","1.067","","","","has coordinates","178568","2020-10-21","18:00:00",""
"4067798","11.709","0.004","22.392","0.009","8.758","0.003","90","","110.97","0.007","90","","2144.2","1.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 B N3 -","- C28 H24 B N3 -","- C112 H96 B4 N12 -","4","1","","Song, Bingxu; Kirschbaum, Kristin; Mason, Mark R.","Planar, Three-Coordinate Boron Monohydrides Ligated by Bis(3-methylindolyl)methanes","Organometallics","2012","31","1","191","","10.1021/om2006694","","","0.71073","MoKα","","0.1305","0.068","","","0.127","0.1502","","","","","","1.019","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067799","8.9175","0.0019","12.367","0.003","13.132","0.003","117.198","0.003","100.154","0.004","100.595","0.004","1208.7","0.5","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H31 B N2 O2 -","- C26 H23 B N2 O -","- C52 H46 B2 N4 O2 -","2","1","","Song, Bingxu; Kirschbaum, Kristin; Mason, Mark R.","Planar, Three-Coordinate Boron Monohydrides Ligated by Bis(3-methylindolyl)methanes","Organometallics","2012","31","1","191","","10.1021/om2006694","","","0.71073","MoKα","","0.0689","0.0496","","","0.1196","0.1258","","","","","","1.051","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4067800","9.6244","0.0013","9.4559","0.0013","20.65","0.003","90","","98.746","0.003","90","","1857.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 B N2 -","- C25 H21 B N2 -","- C100 H84 B4 N8 -","4","1","","Song, Bingxu; Kirschbaum, Kristin; Mason, Mark R.","Planar, Three-Coordinate Boron Monohydrides Ligated by Bis(3-methylindolyl)methanes","Organometallics","2012","31","1","191","","10.1021/om2006694","","","0.71073","MoKα","","0.0673","0.0489","","","0.1045","0.1124","","","","","","1.032","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067801","11.1295","0.0015","29.706","0.003","13.217","0.002","90","","96.1866","0.0018","90","","4344.3","1","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H40 Cl6 P4 Pd -","- C41 H40 Cl6 P4 Pd -","- C164 H160 Cl24 P16 Pd4 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.03","","","","0.0749","","","","","","1.095","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067802","11.9315","0.0011","12.4707","0.0011","15.8027","0.0011","91.876","0.003","105.746","0.0019","112.566","0.003","2064.9","0.3","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H39 Cl F6 N P5 Pd -","- C41 H36 Cl F6 N P5 Pd -","- C82 H72 Cl2 F12 N2 P10 Pd2 -","2","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0452","","","","0.1151","","","","","","1.071","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067803","15.072","0.004","15.753","0.004","15.813","0.004","117.773","0.003","102.087","0.0004","107.32","0.0008","2889.5","1.3","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H59 Ag O10 P4 Pd S3 -","- C60 H57 Ag O10 P4 Pd S3 -","- C120 H114 Ag2 O20 P8 Pd2 S6 -","2","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0491","","","","0.1236","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067804","12.063","0.005","24.465","0.009","20.922","0.008","90","","92.1987","0.0011","90","","6170","4","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H59 Cl12 O P4 Pd Rh -","- C53 H59 Cl12 O P4 Pd Rh -","- C212 H236 Cl48 O4 P16 Pd4 Rh4 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0835","","","","0.2045","","","","","","1.182","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067805","12.242","0.004","15.428","0.005","17.398","0.006","90.395","0.004","108.107","0.004","109.157","0.0015","2928.5","1.7","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C54 H63 Cl5 F6 O P5 Pd Rh -","- C54 H63 Cl5 F6 O P5 Pd Rh -","- C108 H126 Cl10 F12 O2 P10 Pd2 Rh2 -","2","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0748","","","","0.2489","","","","","","1.13","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067806","12.38","0.002","14.534","0.003","17.841","0.003","80.825","0.004","75.642","0.005","79.221","0.004","3033.4","0.9","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H57 Cl9 F6 Ir P5 Pd -","- C52 H57 Cl9 F6 Ir P5 Pd -","- C104 H114 Cl18 F12 Ir2 P10 Pd2 -","2","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0267","","","","0.0633","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067807","23.354","0.005","15.269","0.003","18.148","0.004","90","","90","","90","","6471","2","168","2","168","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C61 H70 Cl10 P4 Pd Rh2 -","- C61 H68 Cl10 P4 Pd Rh2 -","- C244 H272 Cl40 P16 Pd4 Rh8 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0394","","","","0.0959","","","","","","1.243","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067808","23.3745","0.0005","15.303","0.0004","18.1393","0.0004","90","","90","","90","","6488.4","0.3","168","2","168","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C61 H70 Cl10 Ir2 P4 Pd -","- C61 H70 Cl10 Ir2 P4 Pd -","- C244 H280 Cl40 Ir8 P16 Pd4 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0252","","","","0.0527","","","","","","0.981","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067809","23.3351","0.0007","15.3353","0.0004","18.1485","0.0006","90","","90","","90","","6494.5","0.3","173","2","173","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C61 H70 Cl10 Ir P4 Pd Rh -","- C61 H68 Cl10 Ir P4 Pd Rh -","- C244 H272 Cl40 Ir4 P16 Pd4 Rh4 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0302","","","","0.075","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067810","10.848","0.002","33.528","0.006","19.391","0.004","90","","94.726","0.003","90","","7029","2","153","3","153","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 Cl5 F6 O P5 Pd Rh2 -","- C62 H72 Cl5 F6 O P5 Pd Rh2 -","- C248 H288 Cl20 F24 O4 P20 Pd4 Rh8 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.7107","MoKα","","","0.0623","","","","0.1717","","","","","","1.039","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067811","10.964","0.005","33.961","0.015","19.27","0.009","90","","94.775","0.004","90","","7150","6","153","2","153","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 Cl5 F6 Ir O P5 Pd Rh -","- C62 H72 Cl5 F6 Ir O P5 Pd Rh -","- C248 H288 Cl20 F24 Ir4 O4 P20 Pd4 Rh4 -","4","1","","Yoshii, Akiko; Takenaka, Hiroe; Nagata, Hiroko; Noda, Sayo; Nakamae, Kanako; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Heterotrinuclear Complexes with Palladium, Rhodium, and Iridium Ions Assembled by Conformational Switching of a Tetraphosphine Ligand around a Palladium Center","Organometallics","2012","31","1","133","","10.1021/om2006744","","","0.71075","MoKα","","","0.0838","","","","0.2041","","","","","","1.037","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067812","38.5337","0.0007","12.8379","0.0002","20.9599","0.0004","90","","97.235","0.001","90","","10286.1","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H80 N4 Ni P4 -","- C52 H80 N4 Ni P4 -","- C416 H640 N32 Ni8 P32 -","8","1","","Wiedner, Eric S.; Yang, Jenny Y.; Chen, Shentan; Raugei, Simone; Dougherty, William G.; Kassel, W. Scott; Helm, Monte L.; Bullock, R. Morris; Rakowski DuBois, M.; DuBois, Daniel L.","Stabilization of Nickel Complexes with Ni0···H–N Bonding Interactions Using Sterically Demanding Cyclic Diphosphine Ligands","Organometallics","2012","31","1","144","","10.1021/om200709z","","","0.71073","MoKα","","0.2493","0.0701","","","0.0845","0.1286","","","","","","1.039","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067813","13.4155","0.0015","13.7624","0.0015","19.175","0.002","86.22","0.003","70.099","0.003","77.714","0.003","3252.5","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H86 B F4 N6 Ni P4 -","- C56 H86 B F4 N6 Ni P4 -","- C112 H172 B2 F8 N12 Ni2 P8 -","2","1","","Wiedner, Eric S.; Yang, Jenny Y.; Chen, Shentan; Raugei, Simone; Dougherty, William G.; Kassel, W. Scott; Helm, Monte L.; Bullock, R. Morris; Rakowski DuBois, M.; DuBois, Daniel L.","Stabilization of Nickel Complexes with Ni0···H‒N Bonding Interactions Using Sterically Demanding Cyclic Diphosphine Ligands","Organometallics","2012","31","1","144","","10.1021/om200709z","","","0.71073","MoKα","","0.1207","0.0942","","","0.2735","0.2999","","","","","","1.048","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067814","14.876","0.004","11.517","0.003","43.545","0.012","90","","91.718","0.007","90","","7457","3","100","2","100","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C74 H111 B1.5 Co1.5 F6 N7 P6 -","- C74 H111 B1.5 Co1.5 F6 N7 P6 -","- C296 H444 B6 Co6 F24 N28 P24 -","4","1","","Wiedner, Eric S.; Yang, Jenny Y.; Chen, Shentan; Raugei, Simone; Dougherty, William G.; Kassel, W. Scott; Helm, Monte L.; Bullock, R. Morris; Rakowski DuBois, M.; DuBois, Daniel L.","Stabilization of Nickel Complexes with Ni0···H–N Bonding Interactions Using Sterically Demanding Cyclic Diphosphine Ligands","Organometallics","2012","31","1","144","","10.1021/om200709z","","","0.71073","MoKα","","0.1575","0.0666","","","0.1093","0.1339","","","","","","1.016","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067815","58.826","0.003","11.7374","0.0009","19.7396","0.0011","90","","97.174","0.005","90","","13522.8","1.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C73 H67 F12 Mo2 N1.5 O0.25 P6 -","- C73 H66.5 F12 Mo2 N1.5 O0.25 P6 -","- C584 H532 F96 Mo16 N12 O2 P48 -","8","1","","Fitzgerald, Emma C.; Brown, Neil J.; Edge, Ruth; Helliwell, Madeleine; Roberts, Hannah N.; Tuna, Floriana; Beeby, Andrew; Collison, David; Low, Paul J.; Whiteley, Mark W.","Orbital Symmetry Control of Electronic Coupling in a Symmetrical, All-Carbon-Bridged “Mixed Valence” Compound: Synthesis, Spectroscopy, and Electronic Structure of [{Mo(dppe)(η-C7H7)}2(μ-C4)]n+(n= 0, 1, or 2)","Organometallics","2012","31","1","157","","10.1021/om200712m","","","0.71069","MoKα","","0.1306","0.0605","","","0.126","0.1403","","","","","","0.877","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067816","6.1016","0.0012","25.623","0.005","10.717","0.002","90","","96.53","0.03","90","","1664.6","0.6","291","2","291","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36 H43 Cl N4 O Pt -","- C36 H43 Cl N4 O Pt -","- C72 H86 Cl2 N8 O2 Pt2 -","2","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.0508","0.047","","","0.1311","0.1375","","","","","","1.083","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067817","14.607","0.0009","15.8303","0.0009","18.8636","0.0011","90","","90","","90","","4361.9","0.4","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C49 H51 Cl3 N4 Pt -","- C49 H51 Cl3 N4 Pt -","- C196 H204 Cl12 N16 Pt4 -","4","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.0348","0.0254","","","0.0577","0.0616","","","","","","1.035","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067818","49.081","0.01","6.2623","0.0013","10.855","0.002","90","","92.4","0.03","90","","3333.5","1.2","291","2","291","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C36 H41 I N4 Pt -","- C36 H41 I N4 Pt -","- C144 H164 I4 N16 Pt4 -","4","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.0573","0.0471","","","0.091","0.0978","","","","","","1.082","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067819","14.769","0.003","16.384","0.003","18.93","0.004","90","","90","","90","","4580.6","1.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C52 H59 I N4 Pt -","- C52 H59 I N4 Pt -","- C208 H236 I4 N16 Pt4 -","4","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.0674","0.0498","","","0.1003","0.1098","","","","","","1.047","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067820","6.3569","0.0006","22.374","0.002","24.541","0.003","90","","90","","90","","3490.4","0.6","296","2","296","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C31 H47 F3 N4 O4 Pt S -","- C31 H47 F3 N4 O4 Pt S -","- C124 H188 F12 N16 O16 Pt4 S4 -","4","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.1035","0.0508","","","0.0987","0.1182","","","","","","1.002","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067821","10.6347","0.0004","12.1232","0.0004","20.6502","0.0006","90","","90","","90","","2662.36","0.15","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H26 Cl N3 O Pt -","- C31 H26 Cl N3 O Pt -","- C124 H104 Cl4 N12 O4 Pt4 -","4","1","","Hao, Xin-Qi; Xu, Yan-Xiao; Yang, Ming-Jun; Wang, Li; Niu, Jun-Long; Gong, Jun-Fang; Song, Mao-Ping","A Cationic NCN Pincer Platinum(II) Aquo Complex with a Bis(imidazolinyl)phenyl Ligand: Studies toward its Synthesis and Asymmetric Friedel‒Crafts Alkylation of Indoles with Nitroalkenes","Organometallics","2012","31","3","835","","10.1021/om200714z","","","0.71073","MoKα","","0.0452","0.0318","","","0.0355","0.0363","","","","","","1.014","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067822","18.5489","0.0003","18.6181","0.0003","21.6897","0.0004","90.704","0.002","105.772","0.002","103.897","0.002","6973.3","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C63.5 H96 Al4 N8 -","- C63 H95 Al4 N8 -","- C252 H380 Al16 N32 -","4","2","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.111","0.0743","","","0.2259","0.254","","","","","","1.042","","","","has coordinates","303244","2025-11-10","19:34:57",""
"4067823","14.1228","0.0006","14.1451","0.0007","16.4352","0.0008","94.097","0.004","114.481","0.004","101.097","0.004","2889.9","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H64 Al4 N8 -","- C64 H64 Al4 N8 -","- C128 H128 Al8 N16 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.1278","0.0512","","","0.0921","0.1043","","","","","","0.837","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067824","14.9064","0.0004","21.999","0.0005","24.5843","0.0007","90","","100.04","0.003","90","","7938.4","0.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C80 H96 Al4 N8 -","- C73 H88 Al4 N8 -","- C292 H352 Al16 N32 -","4","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.1666","0.0792","","","0.1762","0.2113","","","","","","0.957","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067825","13.0391","0.0004","13.7179","0.0005","14.6836","0.0004","71.654","0.003","65.387","0.003","62.212","0.003","2088.56","0.13","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C40.5 H51.5 Al4 N8 -","- C40.5 H51.5 Al4 N8 -","- C81 H103 Al8 N16 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0691","0.0468","","","0.1068","0.1157","","","","","","1.029","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067826","15.0411","0.0004","15.6755","0.0005","21.7746","0.0006","89.763","0.002","77.295","0.002","87.019","0.002","5001.3","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C96.5 H122 Al5 N10 -","- C93.5 H115 Al5 N10 -","- C187 H230 Al10 N20 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.1221","0.0755","","","0.2118","0.2393","","","","","","1.037","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067827","42.199","0.0012","14.019","0.0003","27.7014","0.0008","90","","101.977","0.003","90","","16031.1","0.8","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C87 H90 Al6 N10 -","- C87 H90 Al6 N10 -","- C696 H720 Al48 N80 -","8","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0924","0.0536","","","0.142","0.1546","","","","","","1.03","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067828","26.8732","0.0007","15.3876","0.0003","19.2603","0.0009","90","","112.737","0.004","90","","7345.5","0.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C63 H94 Al3 Cl7 N8 -","- C63 H94 Al3 Cl7 N8 -","- C252 H376 Al12 Cl28 N32 -","4","0.5","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0646","0.0461","","","0.1164","0.1283","","","","","","1.042","","","","has coordinates,has disorder","301829","2025-08-20","12:17:39",""
"4067829","14.8034","0.0005","15.4522","0.0006","17.9574","0.0006","105.641","0.003","108.308","0.003","104.256","0.003","3500.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C71 H84 Al3 Cl5 N6 -","- C71 H84 Al3 Cl5 N6 -","- C142 H168 Al6 Cl10 N12 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0818","0.0467","","","0.1221","0.1312","","","","","","0.969","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067830","8.203","0.0004","9.3135","0.0004","13.9156","0.0006","85.993","0.004","88.458","0.004","89.708","0.004","1060.14","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H24 Al Cl3 N2 -","- C19 H24 Al Cl3 N2 -","- C38 H48 Al2 Cl6 N4 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0619","0.0355","","","0.0789","0.0852","","","","","","0.984","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067831","8.4839","0.0009","10.0382","0.0008","10.3193","0.0009","103.036","0.007","114.029","0.009","97.801","0.008","755.97","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 Al Cl3 N2 -","- C13 H12 Al Cl3 N2 -","- C26 H24 Al2 Cl6 N4 -","2","1","","Maheswari, K.; Reddy, N. Dastagiri","Reactions of N-Monosubstituted Amidines with AlMe3and AlMeCl2: Formation of Fused Triazaalane Heterocycles","Organometallics","2012","31","1","197","","10.1021/om2007375","","","0.71073","MoKα","","0.0986","0.0549","","","0.1205","0.1285","","","","","","1.086","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067832","28.4705","0.001","9.0217","0.0003","27.1319","0.0014","90","","118.75","0.001","90","","6109.8","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H28 Br F5 N P Pt -","- C34 H28 Br F5 N P Pt -","- C272 H224 Br8 F40 N8 P8 Pt8 -","8","1","","Wang, Tongen; Keyes, Lauren; Patrick, Brian O.; Love, Jennifer A.","Exploration of the Mechanism of Platinum(II)-Catalyzed C‒F Activation: Characterization and Reactivity of Platinum(IV) Fluoroaryl Complexes Relevant to Catalysis","Organometallics","2012","31","4","1397","","10.1021/om2007562","","","0.71073","MoKα","","0.0321","0.0246","","","0.0523","0.0544","","","","","","1.038","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067833","9.4945","0.0007","18.1068","0.0011","18.377","0.001","90","","90.972","0.003","90","","3158.8","0.3","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H35 Br F N2 P Pt -","- C36 H35 Br F N2 P Pt -","- C144 H140 Br4 F4 N8 P4 Pt4 -","4","1","","Wang, Tongen; Keyes, Lauren; Patrick, Brian O.; Love, Jennifer A.","Exploration of the Mechanism of Platinum(II)-Catalyzed C‒F Activation: Characterization and Reactivity of Platinum(IV) Fluoroaryl Complexes Relevant to Catalysis","Organometallics","2012","31","4","1397","","10.1021/om2007562","","","0.71073","MoKα","","0.0593","0.0378","","","0.0848","0.0914","","","","","","1.109","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067834","10.0665","0.0011","10.9552","0.0013","14.784","0.0016","90.901","0.005","90.954","0.005","111.464","0.005","1516.7","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H32 F4 N P Pt -","- C35 H32 F4 N P Pt -","- C70 H64 F8 N2 P2 Pt2 -","2","1","","Wang, Tongen; Keyes, Lauren; Patrick, Brian O.; Love, Jennifer A.","Exploration of the Mechanism of Platinum(II)-Catalyzed C‒F Activation: Characterization and Reactivity of Platinum(IV) Fluoroaryl Complexes Relevant to Catalysis","Organometallics","2012","31","4","1397","","10.1021/om2007562","","","0.71073","MoKα","","0.0171","0.0156","","","0.0366","0.0372","","","","","","1.077","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067835","17.29","0.005","9.934","0.003","25.343","0.008","90","","97.758","0.005","90","","4313","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C55 H41 N4 O5 Rh -","- C55 H41 N4 O5 Rh -","- C220 H164 N16 O20 Rh4 -","4","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.1371","0.0774","","","0.1952","0.2375","","","","","","1.097","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067836","12.1714","0.0007","14.5554","0.0009","15.0768","0.001","91.655","0.001","112.071","0.001","108.896","0.001","2307.1","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H29 F12 N4 O Rh -","- C55 H29 F12 N4 O Rh -","- C110 H58 F24 N8 O2 Rh2 -","2","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0579","0.0469","","","0.1249","0.1367","","","","","","1.03","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067837","29.156","0.003","17.0981","0.0018","19.866","0.002","90","","107.428","0.002","90","","9448.8","1.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C50 H39 N4 O Rh -","- C50 H39 N4 O Rh -","- C400 H312 N32 O8 Rh8 -","8","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0677","0.0477","","","0.1291","0.1375","","","","","","1.008","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067838","22.688","0.006","13.692","0.003","31.635","0.008","90","","102.011","0.004","90","","9612","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H43 N4 O Rh -","- C52 H43 N4 O Rh -","- C416 H344 N32 O8 Rh8 -","8","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0562","0.041","","","0.1061","0.1129","","","","","","1.043","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067839","13.8403","0.0015","24.524","0.003","15.62","0.0017","90","","95.666","0.002","90","","5275.8","1","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H49 N4 O2 Rh -","- C56 H49 N4 O2 Rh -","- C224 H196 N16 O8 Rh4 -","4","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0983","0.0731","","","0.1911","0.2057","","","","","","1.067","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067840","21.897","0.003","25.195","0.003","17.378","0.003","90","","90","","90","","9587","2","123","2","123","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C55 H47 N4 O2 Rh -","- C55 H47 N4 O2 Rh -","- C440 H376 N32 O16 Rh8 -","8","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0847","0.0697","","","0.1914","0.2029","","","","","","1.097","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067841","12.713","0.002","13.353","0.002","15.503","0.003","83.385","0.003","71.674","0.003","83.365","0.003","2472.8","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H43 N4 O Rh -","- C56 H43 N4 O Rh -","- C112 H86 N8 O2 Rh2 -","2","1","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.1681","0.0819","","","0.2312","0.2906","","","","","","1.017","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067842","12.318","0.0004","17.2038","0.0006","12.0957","0.0004","90","","97.676","0.001","90","","2540.31","0.15","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C57 H45 N4 O Rh -","- C57 H45 N4 O Rh -","- C114 H90 N8 O2 Rh2 -","2","0.5","","Fung, Hong Sang; Li, Bao Zhu; Chan, Kin Shing","Mild and Selective C(CO)‒C(α) Bond Cleavage of Ketones by Rhodium(III) Porphyrins: Scope and Mechanism","Organometallics","2012","31","2","570","","10.1021/om200788p","","","0.71073","MoKα","","0.0611","0.0566","","","0.1616","0.1684","","","","","","1.126","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067843","16.2833","0.0002","15.5893","0.0002","25.8409","0.0003","90","","93.97","0.001","90","","6543.85","0.14","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C60 H41 B Cl2 F24 N9 O P Pt -","- C60 H41 B Cl2 F24 N9 O P Pt -","- C240 H164 B4 Cl8 F96 N36 O4 P4 Pt4 -","4","1","","Frauhiger, Bryan E.; White, Peter S.; Templeton, Joseph L.","C‒H and C‒C Bond Formation Promoted by Facile κ3/κ2Interconversions in a Hemilabile “Click”-Triazole Scorpionate Platinum System","Organometallics","2012","31","1","225","","10.1021/om2007997","","","1.54178","CuKα","","0.028","0.0273","","","0.0667","0.0672","","","","","","1.073","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067844","13.5319","0.0016","9.1853","0.0007","17.734","0.002","90","","110.168","0.009","90","","2069.1","0.4","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N2 Te -","- C24 H24 N2 Te -","- C96 H96 N8 Te4 -","4","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","New Series of Intramolecularly Coordinated Diaryltellurium Compounds. Rational Synthesis of the Diarylhydroxytelluronium Triflate [(8-Me2NC10H6)2Te(OH)](O3SCF3)","Organometallics","2012","31","1","238","","10.1021/om2008259","","","0.71073","MoKα","","0.0624","0.0277","","","0.0535","0.0579","","","","","","0.812","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067845","9.577","0.007","23.245","0.009","10.46","0.006","90","","106.92","0.05","90","","2228","2","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 N2 O5 Te -","- C24 H24 N2 O5 Te -","- C96 H96 N8 O20 Te4 -","4","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","New Series of Intramolecularly Coordinated Diaryltellurium Compounds. Rational Synthesis of the Diarylhydroxytelluronium Triflate [(8-Me2NC10H6)2Te(OH)](O3SCF3)","Organometallics","2012","31","1","238","","10.1021/om2008259","","","0.71073","MoKα","","0.1928","0.0457","","","0.0623","0.1069","","","","","","0.862","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067846","9.566","0.0016","23.122","0.003","10.4331","0.0016","90","","106.51","0.012","90","","2212.5","0.6","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 N2 O4 Te -","- C24 H24 N2 O4 Te -","- C96 H96 N8 O16 Te4 -","4","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","New Series of Intramolecularly Coordinated Diaryltellurium Compounds. Rational Synthesis of the Diarylhydroxytelluronium Triflate [(8-Me2NC10H6)2Te(OH)](O3SCF3)","Organometallics","2012","31","1","238","","10.1021/om2008259","","","0.71073","MoKα","","0.1287","0.0528","","","0.0982","0.1238","","","","","","0.876","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067847","9.982","0.005","9.237","0.009","28.559","0.018","90","","107.19","0.05","90","","2516","3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 F3 N2 O4 S Te -","- C25 H25 F3 N2 O4 S Te -","- C100 H100 F12 N8 O16 S4 Te4 -","4","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","New Series of Intramolecularly Coordinated Diaryltellurium Compounds. Rational Synthesis of the Diarylhydroxytelluronium Triflate [(8-Me2NC10H6)2Te(OH)](O3SCF3)","Organometallics","2012","31","1","238","","10.1021/om2008259","","","0.71073","MoKα","","0.1295","0.0536","","","0.092","0.1171","","","","","","0.867","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067848","10.7285","0.0003","14.9875","0.0004","13.2512","0.0003","90","","95.157","0.002","90","","2122.08","0.1","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H23 B0 P -","- C25 H23 B P2 -","- C100 H92 B4 P8 -","4","1","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.0477","0.0348","","","0.0953","0.102","","","","","","1.058","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067849","6.905","","11.867","","13.532","","69.43","","76.71","","83.3","","1009.55","","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H27 B P2 -","- C21 H27 B P2 -","- C42 H54 B2 P4 -","2","1","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.0565","0.0451","","","0.1151","0.1257","","","","","","1.145","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067850","21.7995","0.0006","10.3959","0.0003","18.0133","0.0005","90","","102.674","0.003","90","","3982.8","0.2","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H20 P2 -","- C25 H20 P2 -","- C200 H160 P16 -","8","2","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.0625","0.0403","","","0.0945","0.1024","","","","","","1.024","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067851","12.7465","0.0013","29.866","0.003","6.0097","0.0005","90","","90","","90","","2287.8","0.4","180","2","180","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C40 H40 P2 -","- C29 H24 P2 -","- C116 H96 P8 -","4","1","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.1851","0.1525","","","0.3339","0.3495","","","","","","1.064","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4067852","10.5502","0.0004","11.3776","0.0004","14.6834","0.0006","86.543","0.003","76.688","0.003","84.72","0.003","1706.51","0.11","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H39 B2 F4 P2 Rh -","- C37 H39 B2 F4 P2 Rh -","- C74 H78 B4 F8 P4 Rh2 -","2","1","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.0509","0.0379","","","0.0957","0.103","","","","","","1.046","","","","has coordinates,has disorder","301829","2025-08-20","12:17:39",""
"4067853","10.7297","0.0007","10.9416","0.0007","14.2511","0.0009","95.701","0.005","93.508","0.005","95.731","0.005","1652.21","0.19","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H41 B2 Cl2 F4 P2 Rh -","- C30 H41 B2 Cl2 F4 P2 Rh -","- C60 H82 B4 Cl4 F8 P4 Rh2 -","2","1","","Nguyen, Duc Hanh; Bayardon, Jérôme; Salomon-Bertrand, Christine; Jugé, Sylvain; Kalck, Philippe; Daran, Jean-Claude; Urrutigoity, Martine; Gouygou, Maryse","Modular Phosphole-Methano-Bridged-Phosphine(Borane) Ligands. Application to Rhodium-Catalyzed Reactions","Organometallics","2012","31","3","857","","10.1021/om2008265","","","0.71073","MoKα","","0.062","0.0395","","","0.0869","0.0931","","","","","","0.945","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067854","30.494","0.002","11.1789","0.0007","22.9459","0.0014","90","","91.76","0.005","90","","7818.3","0.9","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H57 Ge O0.5 P2 S2 Si4 -","- C30 H57 Ge O0.5 P2 S2 Si4 -","- C240 H456 Ge8 O4 P16 S16 Si32 -","8","1","","Izod, Keith; Clark, Ewan R.; Clegg, William; Harrington, Ross W.","Hypervalent Sulfur-Functionalized Diphosphagermylene and Diphosphastannylene Compounds","Organometallics","2012","31","1","246","","10.1021/om2008327","","","0.71073","MoKα","","0.1688","0.0614","","","0.058","0.0676","","","","","","0.955","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067855","16.9798","0.0015","11.0771","0.001","23.0424","0.0018","90","","99.466","0.008","90","","4275","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H62 O P2 S2 Si4 Sn -","- C32 H62 O P2 S2 Si4 Sn -","- C128 H248 O4 P8 S8 Si16 Sn4 -","4","1","","Izod, Keith; Clark, Ewan R.; Clegg, William; Harrington, Ross W.","Hypervalent Sulfur-Functionalized Diphosphagermylene and Diphosphastannylene Compounds","Organometallics","2012","31","1","246","","10.1021/om2008327","","","0.71073","MoKα","","0.1001","0.0596","","","0.1594","0.1694","","","","","","0.997","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067856","10.4746","0.0002","21.3062","0.0004","18.4807","0.0003","90","","102.312","0.0019","90","","4029.56","0.13","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H59 P2 S2 Si4 Sn -","- C31 H59 P2 S2 Si4 Sn -","- C124 H236 P8 S8 Si16 Sn4 -","4","1","","Izod, Keith; Clark, Ewan R.; Clegg, William; Harrington, Ross W.","Hypervalent Sulfur-Functionalized Diphosphagermylene and Diphosphastannylene Compounds","Organometallics","2012","31","1","246","","10.1021/om2008327","","","0.71073","MoKα","","0.0387","0.023","","","0.0478","0.0495","","","","","","0.902","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067857","9.6864","0.0004","8.3921","0.0003","23.1898","0.0012","90","","94.973","0.004","90","","1877.99","0.14","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Cl3 Li O5 Sn -","- C12 H24 Cl3 Li O5 Sn -","- C48 H96 Cl12 Li4 O20 Sn4 -","4","1","","Izod, Keith; Clark, Ewan R.; Clegg, William; Harrington, Ross W.","Hypervalent Sulfur-Functionalized Diphosphagermylene and Diphosphastannylene Compounds","Organometallics","2012","31","1","246","","10.1021/om2008327","","","0.71073","MoKα","","0.0342","0.0232","","","0.0534","0.0556","","","","","","1.02","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067858","19.6717","0.0007","11.3658","0.0004","15.8141","0.0005","90","","91.836","0.003","90","","3534","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H52 P2 S2 Si4 -","- C28 H52 P2 S2 Si4 -","- C112 H208 P8 S8 Si16 -","4","1","","Izod, Keith; Clark, Ewan R.; Clegg, William; Harrington, Ross W.","Hypervalent Sulfur-Functionalized Diphosphagermylene and Diphosphastannylene Compounds","Organometallics","2012","31","1","246","","10.1021/om2008327","","","0.71073","MoKα","","0.0533","0.0477","","","0.1152","0.1195","","","","","","1.061","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067859","33.935","0.005","33.935","0.005","112.33","0.02","90","","90","","120","","112027","3","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C342 H359 Ag16 Cl5 Cu9 O20 P9 -","- C341.91 H351 Ag16 Cu9 P9 -","- C4102.92 H4212 Ag192 Cu108 P108 -","12","0.333333","","Chen, Zhong-Hui; Zhang, Li-Yi; Chen, Zhong-Ning","Structural Characterization and Luminescence Properties of a Triphosphine-Stabilized Ag16Cu9Heterometallic Alkynyl Cluster","Organometallics","2012","31","1","256","","10.1021/om200836k","","","0.8","","","0.1325","0.1041","","","0.2423","0.2567","","","","","","1.193","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067860","5.982","0.0002","7.6731","0.0003","35.2705","0.0015","90","","90.562","0.002","90","","1618.86","0.11","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 Ag2 Cl2 N4 O -","- C12 H18 Ag2 Cl2 N4 O -","- C48 H72 Ag8 Cl8 N16 O4 -","4","1","","Lund, Clinton L.; Sgro, Michael J.; Stephan, Douglas W.","Neutral and Cationic Tridentate Bis(N-heterocyclic carbene) Ether Ruthenium Alkylidene Complexes in Metathesis","Organometallics","2012","31","2","580","","10.1021/om200848d","","","0.71073","MoKα","","0.1102","0.1046","","","0.2004","0.2036","","","","","","1.066","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067861","18.4269","0.0014","12.7319","0.0009","14.8172","0.001","90","","108.93","0.003","90","","3288.2","0.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 Cl4 N4 O P Ru -","- C31 H35 Cl4 N4 O P Ru -","- C124 H140 Cl16 N16 O4 P4 Ru4 -","4","1","","Lund, Clinton L.; Sgro, Michael J.; Stephan, Douglas W.","Neutral and Cationic Tridentate Bis(N-heterocyclic carbene) Ether Ruthenium Alkylidene Complexes in Metathesis","Organometallics","2012","31","2","580","","10.1021/om200848d","","","0.71073","MoKα","","0.1045","0.0866","","","0.1977","0.2079","","","","","","1.18","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067862","8.452","0.005","22.009","0.005","13.024","0.005","90","0.005","98.974","0.005","90","0.005","2393.1","1.8","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Cl4 N4 O Ru -","- C20 H26 Cl4 N4 O Ru -","- C80 H104 Cl16 N16 O4 Ru4 -","4","1","","Lund, Clinton L.; Sgro, Michael J.; Stephan, Douglas W.","Neutral and Cationic Tridentate Bis(N-heterocyclic carbene) Ether Ruthenium Alkylidene Complexes in Metathesis","Organometallics","2012","31","2","580","","10.1021/om200848d","","","0.71073","MoKα","","0.0734","0.0398","","","0.0765","0.0871","","","","","","1.019","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067863","7.8822","0.0006","9.7102","0.0008","13.6698","0.0011","89.616","0.005","82.415","0.005","76.296","0.005","1007.25","0.14","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H24 Cl2 N4 O Ru -","- C19 H24 Cl2 N4 O Ru -","- C38 H48 Cl4 N8 O2 Ru2 -","2","1","","Lund, Clinton L.; Sgro, Michael J.; Stephan, Douglas W.","Neutral and Cationic Tridentate Bis(N-heterocyclic carbene) Ether Ruthenium Alkylidene Complexes in Metathesis","Organometallics","2012","31","2","580","","10.1021/om200848d","","","0.71073","MoKα","","0.097","0.0593","","","0.1481","0.1676","","","","","","1.046","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067864","10.8202","0.001","13.4675","0.0012","25.998","0.002","90","","96.299","0.004","90","","3765.6","0.6","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C74 H48 B2 Cl4 F30 N8 O2 Ru2 -","- C74 H48 B2 Cl4 F30 N8 O2 Ru2 -","- C148 H96 B4 Cl8 F60 N16 O4 Ru4 -","2","0.5","","Lund, Clinton L.; Sgro, Michael J.; Stephan, Douglas W.","Neutral and Cationic Tridentate Bis(N-heterocyclic carbene) Ether Ruthenium Alkylidene Complexes in Metathesis","Organometallics","2012","31","2","580","","10.1021/om200848d","","","0.71073","MoKα","","0.0694","0.0516","","","0.141","0.1532","","","","","","1.031","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067865","9.7516","0.0002","15.3223","0.0002","18.6487","0.0004","114.2","0.002","90.494","0.002","106.366","0.002","2413.93","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H53 N O5 P2 Pd -","- C56 H53 N O5 P2 Pd -","- C112 H106 N2 O10 P4 Pd2 -","2","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0373","0.0284","","","0.072","0.0738","","","","","","1.048","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067866","8.6025","0.0002","9.8853","0.0003","22.1723","0.0006","102.603","0.002","93.391","0.002","92.431","0.002","1833.88","0.09","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H37 N O4 P2 Pd -","- C38 H37 N O4 P2 Pd -","- C76 H74 N2 O8 P4 Pd2 -","2","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0673","0.0455","","","0.101","0.1055","","","","","","0.943","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067867","12.19","0.004","12.59","0.002","13.333","0.003","67.93","0.005","76.261","0.012","61.17","0.01","1657.3","0.7","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C76 H74 N2 O8 P3 Pd2 -","- C76 H74 N2 O8 P4 Pd2 -","- C76 H74 N2 O8 P4 Pd2 -","1","0.5","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0369","0.0269","","","0.0627","0.0656","","","","","","1.016","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067868","9.4951","0.0003","14.3559","0.0005","18.8085","0.0007","84.034","0.002","80.54","0.002","73.842","0.002","2424.45","0.15","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H49 Cl N O4 P2 Pd -","- C58 H48 Cl N O4 P2 Pd -","- C116 H96 Cl2 N2 O8 P4 Pd2 -","2","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0364","0.029","","","0.087","0.0933","","","","","","1.052","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067869","9.6523","0.0004","14.5248","0.0007","18.521","0.0009","84.013","0.002","81.214","0.002","74.762","0.001","2470.3","0.2","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H48 N2 O6 P2 Pd -","- C58 H48 N2 O6 P2 Pd -","- C116 H96 N4 O12 P4 Pd2 -","2","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0446","0.0367","","","0.0955","0.1018","","","","","","1.047","","","","has coordinates","301829","2025-08-20","12:17:39",""
"4067870","23.3448","0.0009","9.6937","0.0003","19.6595","0.0007","90","","92.46","0.002","90","","4444.8","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H43 N O5 P2 Pd -","- C52 H43 N O5 P2 Pd -","- C208 H172 N4 O20 P8 Pd4 -","4","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0331","0.0274","","","0.0628","0.0653","","","","","","0.955","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067871","47.8785","0.0016","9.8204","0.0004","19.4453","0.0007","90","","108.515","0.001","90","","8669.7","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H41 N O4 P2 Pd -","- C51 H41 N O4 P2 Pd -","- C408 H328 N8 O32 P16 Pd8 -","8","1","","Buchner, Magnus R.; Bechlars, Bettina; Wahl, Bernhard; Ruhland, Klaus","Influence of Electronically and Sterically Tunable Cinnamate Ligands on the Spectroscopic, Kinetic, and Thermodynamic Properties of Bis(triphenylphosphine)palladium(0) Olefin Complexes","Organometallics","2012","31","2","588","","10.1021/om200849n","","","0.71073","MoKα","","0.0251","0.0215","","","0.0523","0.0546","","","","","","1.061","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067872","12.1126","0.0007","14.4046","0.0008","14.4964","0.0008","90","","90.566","0.001","90","","2529.2","0.2","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","unimc13","","","- C24 H34 Cl4 Ru2 -","- C24 H34 Cl4 Ru2 -","- C96 H136 Cl16 Ru8 -","4","1","","Fier, Patrick S.; Reinig, Regina R.; King, Janeth; Dickerson, Christopher; Chin, Robert M.; Doucouré, Mantia; Brennessel, William","Selective Dialkylation of a Doubly Linked Dicyclopentadiene Ligand and the Ensuing Ruthenium Complexes","Organometallics","2012","31","1","261","","10.1021/om200854n","","","0.71073","MoKα","","0.0615","0.0399","","","0.0775","0.0853","","","","","","1.031","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067873","13.441","0.004","17.036","0.005","19.978","0.006","110.431","0.005","107.181","0.005","94.532","0.005","4010","2","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","unimc15","","","- C34 H49 Cl4 N5 Ru2 Zn -","- C34 H49 Cl4 N5 Ru2 Zn -","- C136 H196 Cl16 N20 Ru8 Zn4 -","4","2","","Fier, Patrick S.; Reinig, Regina R.; King, Janeth; Dickerson, Christopher; Chin, Robert M.; Doucouré, Mantia; Brennessel, William","Selective Dialkylation of a Doubly Linked Dicyclopentadiene Ligand and the Ensuing Ruthenium Complexes","Organometallics","2012","31","1","261","","10.1021/om200854n","","","0.71073","MoKα","","0.1521","0.075","","","0.1882","0.2336","","","","","","1.018","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067874","10.0768","0.0006","14.6139","0.0008","21.3322","0.0012","76.467","0.002","76.789","0.001","70.187","0.002","2834.9","0.3","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H31 B Br Cr N6 S3 -","- C22 H31 B Br Cr N6 S3 -","- C88 H124 B4 Br4 Cr4 N24 S12 -","4","2","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.1428","0.0853","","","0.1871","0.2159","","","","","","1.055","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067875","28.3957","0.0016","11.6257","0.0006","20.392","0.0011","90","","131.628","0.002","90","","5031.8","0.5","223","2","223","2","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C19 H29.5 B Br Cr N4 O0.25 S2 -","- C19 H29.5 B Br Cr N4 O0.25 S2 -","- C152 H236 B8 Br8 Cr8 N32 O2 S16 -","8","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.1291","0.0899","","","0.2089","0.2329","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067876","16.9441","0.0005","10.8424","0.0003","27.3449","0.0008","90","","98.903","0.001","90","","4963.1","0.2","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 B Br Cr N6 S2 -","- C21 H29 B Br Cr N6 S2 -","- C168 H232 B8 Br8 Cr8 N48 S16 -","8","2","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.1055","0.0917","","","0.189","0.1955","","","","","","1.29","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067877","16.7803","0.0008","15.3114","0.0007","14.9394","0.0007","90","","111.748","0.001","90","","3565.2","0.3","223","2","223","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C26 H43 B Cr F6 N6 O P S2 -","- C26 H43 B Cr F6 N6 O P S2 -","- C104 H172 B4 Cr4 F24 N24 O4 P4 S8 -","4","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.061","0.0536","","","0.1276","0.1321","","","","","","1.138","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067878","23.0271","0.0011","18.2357","0.0009","15.2357","0.0007","90","","129.698","0.001","90","","4922.5","0.4","223","2","223","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C18 H27 B Cr F6 N4 P S2 -","- C18 H27 B Cr F6 N4 P S2 -","- C144 H216 B8 Cr8 F48 N32 P8 S16 -","8","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.085","0.0655","","","0.1665","0.1799","","","","","","1.029","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067879","12.4508","0.0006","8.9491","0.0004","27.4984","0.0013","90","","96.305","0.001","90","","3045.4","0.2","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 B Cr F6 N7 P S2 -","- C23 H32 B Cr F6 N7 P S2 -","- C92 H128 B4 Cr4 F24 N28 P4 S8 -","4","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich Cp*Cr Complexes Containing Poly(methimazolyl)borates (Cp* = C5Me5): Syntheses and Structural and Electrochemical Studies","Organometallics","2012","31","1","273","","10.1021/om2008666","","","0.71073","MoKα","","0.0575","0.0478","","","0.1172","0.1229","","","","","","1.072","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067880","10.3588","0.0003","14.6446","0.0004","13.8385","0.0004","90","","100.118","0.001","90","","2066.66","0.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H32 Al N3 -","- C20 H32 Al N3 -","- C80 H128 Al4 N12 -","4","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.0608","0.0404","","","0.0917","0.101","","","","","","1.025","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067881","9.6263","0.0004","13.808","0.0004","21.7929","0.0008","90","","93.143","0.002","90","","2892.35","0.18","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H43 Al N4 O -","- C29 H43 Al N4 O -","- C116 H172 Al4 N16 O4 -","4","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.0663","0.0474","","","0.1143","0.1273","","","","","","1.009","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067882","10.3063","0.0002","11.376","0.0002","15.3201","0.0003","89.29","0.001","89.348","0.001","72.542","0.001","1713.27","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H58 Al N5 -","- C34 H58 Al N5 -","- C68 H116 Al2 N10 -","2","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.0722","0.0476","","","0.1111","0.1212","","","","","","1.063","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067883","11.6662","0.0006","16.4421","0.0008","15.8731","0.0008","90","","100.599","0.002","90","","2992.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H42 B N3 -","- C36 H42 B N3 -","- C144 H168 B4 N12 -","4","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.0993","0.0525","","","0.1043","0.1239","","","","","","1.011","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067884","9.3521","0.0005","20.4369","0.0012","19.4853","0.0013","90","","95.189","0.005","90","","3708.9","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H49 B N4 O -","- C44 H49 B N4 O -","- C176 H196 B4 N16 O4 -","4","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.0947","0.0533","","","0.1035","0.1212","","","","","","1.035","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067885","13.5261","0.0003","13.5261","0.0003","21.1284","0.001","90","","90","","90","","3865.6","0.2","150","2","150","2","","","","","","","","5","P 43","P 4cw","78","","","","- C40 H56 Al N5 O3 -","- C36 H46 Al N5 O2 -","- C144 H184 Al4 N20 O8 -","4","1","","Tai, Chia-Cheng; Chang, Ya-Ting; Tsai, Jie-Hong; Jurca, Titel; Yap, Glenn P. A.; Ong, Tiow-Gan","Subtle Reactivities of Boron and Aluminum Complexes with Amino-Linked N-Heterocyclic Carbene Ligation","Organometallics","2012","31","2","637","","10.1021/om200878e","","","0.71073","MoKα","","0.1804","0.0964","","","0.2139","0.2368","","","","","","1.07","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067886","8.1885","0.0006","20.5473","0.0013","20.8831","0.001","90","","95.301","0.005","90","","3498.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 F12 N8 Ni P2 -","- C30 H28 F12 N8 Ni P2 -","- C120 H112 F48 N32 Ni4 P8 -","4","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","1.54178","CuKα","","0.0812","0.072","","","0.1974","0.2078","","","","","","1.045","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067887","14.5148","0.0003","16.2759","0.0003","24.885","0.0005","90","","95.664","0.002","90","","5850.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H48 F12 N16 Ni P2 -","- C54 H48 F12 N16 Ni P2 -","- C216 H192 F48 N64 Ni4 P8 -","4","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","0.71073","MoKα","","0.0784","0.0587","","","0.1597","0.1723","","","","","","1.047","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067888","8.9482","0.0006","10.0347","0.0008","11.5888","0.0008","72.059","0.007","84.31","0.006","67.579","0.007","914.95","0.13","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H14 Cl F6 N4 P Pd -","- C15 H14 Cl F6 N4 P Pd -","- C30 H28 Cl2 F12 N8 P2 Pd2 -","2","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","1.54178","CuKα","","0.0516","0.0487","","","0.1323","0.1361","","","","","","1.049","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067889","11.4331","0.0008","11.9186","0.0004","12.5722","0.0005","107.773","0.003","93.729","0.004","97.765","0.004","1606.16","0.14","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H27 Cl F6 N9 P Pd -","- C29 H27 Cl F6 N9 P Pd -","- C58 H54 Cl2 F12 N18 P2 Pd2 -","2","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","0.71073","MoKα","","0.0539","0.0397","","","0.0853","0.0946","","","","","","1.05","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067890","11.4204","0.0005","11.9366","0.0005","12.5818","0.0005","107.726","0.004","93.539","0.004","97.858","0.004","1608.65","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H27 Cl F6 N9 P Pt -","- C29 H27 Cl F6 N9 P Pt -","- C58 H54 Cl2 F12 N18 P2 Pt2 -","2","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","0.71073","MoKα","","0.0437","0.0328","","","0.066","0.0709","","","","","","1.025","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067891","24.521","0.003","12.3041","0.001","19.672","0.002","90","","104.803","0.007","90","","5738.2","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H48 Co F18 N16 P3 -","- C54 H48 Co F18 N16 P3 -","- C216 H192 Co4 F72 N64 P12 -","4","0.5","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","0.71073","MoKα","","0.0805","0.0687","","","0.1892","0.202","","","","","","1.061","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067892","8.125","0.0003","14.2921","0.0005","23.9513","0.0008","90","","94.439","0.003","90","","2772.96","0.17","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 Cl F6 N6 P Ru -","- C23 H24 Cl F6 N6 P Ru -","- C92 H96 Cl4 F24 N24 P4 Ru4 -","4","1","","Liu, Bo; Liu, Xiaolong; Chen, Chao; Chen, Congyan; Chen, Wanzhi","Carbene Transfer Reactivities of Nickel(II)‒N-Heterocyclic Carbene Complexes and Their Applications in the Synthesis of Metal‒NHC Complexes","Organometallics","2012","31","1","282","","10.1021/om200881s","","","0.71073","MoKα","","0.0677","0.0515","","","0.1311","0.1423","","","","","","1.073","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067893","9.7276","0.0002","11.2587","0.0002","21.964","0.0005","78.6497","0.0007","87.4688","0.0007","84.6684","0.0008","2347.43","0.08","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C60 H56 O Zr -","- C60 H56 O Zr -","- C120 H112 O2 Zr2 -","2","1","","Manz, Thomas A.; Caruthers, James M.; Sharma, Shalini; Phomphrai, Khamphee; Thomson, Kendall T.; Delgass, W. Nicholas; Abu-Omar, Mahdi M.","Structure‒Activity Correlation for Relative Chain Initiation to Propagation Rates in Single-Site Olefin Polymerization Catalysis","Organometallics","2012","31","2","602","","10.1021/om200884x","","","0.71073","MO-Kα","","0.05","0.037","","","0.086","0.09","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067894","10.9415","0.0007","27.5346","0.0018","12.2533","0.0005","90","","101.981","0.004","90","","3611.1","0.4","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C43 H39 Cl2 O Zr -","- C43 H39 Cl2 O Zr -","- C172 H156 Cl8 O4 Zr4 -","4","2","","Manz, Thomas A.; Caruthers, James M.; Sharma, Shalini; Phomphrai, Khamphee; Thomson, Kendall T.; Delgass, W. Nicholas; Abu-Omar, Mahdi M.","Structure‒Activity Correlation for Relative Chain Initiation to Propagation Rates in Single-Site Olefin Polymerization Catalysis","Organometallics","2012","31","2","602","","10.1021/om200884x","","","0.71073","MO-Kα","","0.075","0.056","","","0.131","0.142","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067895","11.3914","0.0005","25.2126","0.001","11.5847","0.0005","90","","114.31","0.002","90","","3032.2","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 B F17 P -","- C29 H24 B F17 P -","- C116 H96 B4 F68 P4 -","4","1","","Caputo, Christopher B.; Stephan, Douglas W.","Activation of Alkyl C‒F Bonds by B(C6F5)3: Stoichiometric and Catalytic Transformations","Organometallics","2012","31","1","27","","10.1021/om200885c","","","0.71073","MoKα","","0.1025","0.0677","","","0.1895","0.2165","","","","","","1.037","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067896","11.7609","0.0003","24.5495","0.0006","12.6226","0.0003","90","","114.154","0.001","90","","3325.37","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H33 B F17 P -","- C33 H33 B F17 P -","- C132 H132 B4 F68 P4 -","4","1","","Caputo, Christopher B.; Stephan, Douglas W.","Activation of Alkyl C–F Bonds by B(C6F5)3: Stoichiometric and Catalytic Transformations","Organometallics","2012","31","1","27","","10.1021/om200885c","","","0.71073","MoKα","","0.0571","0.038","","","0.0869","0.0952","","","","","","1.017","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067897","10.811","0.0009","20.7384","0.0018","14.2736","0.0012","90","","99.331","0.002","90","","3157.8","0.5","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","5b in manuscript","","","- C14 H20 Au Cl N2 O2 -","- C14 H20 Au0.9999 Cl N2 O2 -","- C112 H160 Au7.9992 Cl8 N16 O16 -","8","2","","Hashmi, A. Stephen K.; Yu, Yang; Rominger, Frank","Efficient One-Pot Synthesis of Unsymmetrical Gold(I) N-Heterocyclic Carbene Complexes and Their Use as Catalysts","Organometallics","2012","31","3","895","","10.1021/om2008919","","","0.71073","MoKα","","0.0761","0.0558","","","0.1188","0.127","","","","","","1.121","","","","has coordinates,has disorder","178569","2020-10-21","18:00:00",""
"4067898","30.851","0.003","16.5998","0.0016","17.5738","0.0017","90","","99.866","0.004","90","","8866.8","1.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H44 B Cl2 Ir N2 O2 -","- C48 H44 B Cl2 Ir N2 O2 -","- C384 H352 B8 Cl16 Ir8 N16 O16 -","8","1","","Vadavi, Ramesh S.; Kim, Hyungjun; Lee, Kang Mun; Kim, Taewon; Lee, Junseong; Lee, Yoon Sup; Lee, Min Hyung","Turning On MLCT Phosphorescence of Iridium(III)‒Borane Conjugates upon Fluoride Binding","Organometallics","2012","31","1","31","","10.1021/om2008937","","","0.71073","MoKα","","0.1505","0.0716","","","0.151","0.1708","","","","","","1.011","","","","has coordinates","178569","2020-10-21","18:00:00",""
"4067899","18.066","0.003","18.59","0.003","20.431","0.003","90.943","0.005","110.07","0.005","118.884","0.004","5503","1.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H70 B F Ir N4 O2.5 -","- C59 H70 B F Ir N4 O2.5 -","- C236 H280 B4 F4 Ir4 N16 O10 -","4","2","","Vadavi, Ramesh S.; Kim, Hyungjun; Lee, Kang Mun; Kim, Taewon; Lee, Junseong; Lee, Yoon Sup; Lee, Min Hyung","Turning On MLCT Phosphorescence of Iridium(III)–Borane Conjugates upon Fluoride Binding","Organometallics","2012","31","1","31","","10.1021/om2008937","","","0.71073","MoKα","","0.0792","0.0409","","","0.0937","0.1271","","","","","","1.025","","","","has coordinates,has disorder","303244","2025-11-10","19:34:57",""
"4067900","10.808","0.012","10.936","0.012","12.702","0.011","108.88","0.08","90.79","0.08","95.28","0.09","1413","3","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H28 N2 O11 Te2 -","- C24 H28 N2 O11 Te2 -","- C48 H56 N4 O22 Te4 -","2","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","Synthesis and Structure of an Intramolecularly Coordinated Diaryltelluronic Acid and Its Dimethyl Ester","Organometallics","2012","31","1","289","","10.1021/om2008953","","","0.71073","MoKα","","0.0523","0.0334","","","0.0779","0.0945","","","","","","0.932","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067901","10.982","0.008","23.84","0.02","11.868","0.009","90","","111.15","0.06","90","","2898","4","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H36 N2 O8 Te2 -","- C27 H36 N2 O8 Te2 -","- C108 H144 N8 O32 Te8 -","4","1","","Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela","Synthesis and Structure of an Intramolecularly Coordinated Diaryltelluronic Acid and Its Dimethyl Ester","Organometallics","2012","31","1","289","","10.1021/om2008953","","","0.71073","MoKα","","0.1225","0.0633","","","0.1316","0.1474","","","","","","0.879","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067902","5.8681","0.0012","8.9177","0.0018","10.93","0.002","101.14","0.03","103.6","0.03","100.34","0.02","530.1","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H7 F4 N -","- C13 H7 F4 N -","- C26 H14 F8 N2 -","2","1","","Orbach, Meital; Choudhury, Joyanta; Lahav, Michal; Zenkina, Olena V.; Diskin-Posner, Yael; Leitus, Gregory; Iron, Mark A.; van der Boom, Milko E.","Palladium-Catalyzed Cross-Coupling Reactions with Fluorinated Substrates: Mechanistic Insights into the Undesired Hydrodehalogenation of Aryl Halides","Organometallics","2012","31","4","1271","","10.1021/om200898t","","","0.71073","MoKα","","0.0758","0.0489","","","0.1185","0.1332","","","","","","1.074","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067903","15.967","0.003","13.233","0.003","13.854","0.003","90","","102.6","0.03","90","","2856.7","1.1","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Br F4 N P2 Pd -","- C25 H36 Br F4 N P2 Pd -","- C100 H144 Br4 F16 N4 P8 Pd4 -","4","1","","Orbach, Meital; Choudhury, Joyanta; Lahav, Michal; Zenkina, Olena V.; Diskin-Posner, Yael; Leitus, Gregory; Iron, Mark A.; van der Boom, Milko E.","Palladium-Catalyzed Cross-Coupling Reactions with Fluorinated Substrates: Mechanistic Insights into the Undesired Hydrodehalogenation of Aryl Halides","Organometallics","2012","31","4","1271","","10.1021/om200898t","","","0.71073","MoKα","","0.0459","0.0306","","","0.062","0.068","","","","","","1.016","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4067904","8.5023","0.0002","12.6579","0.0003","25.8658","0.0005","90","","98.764","0.001","90","","2751.21","0.11","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 F4 N P2 Pd -","- C25 H37 F4 N P2 Pd -","- C100 H148 F16 N4 P8 Pd4 -","4","1","","Orbach, Meital; Choudhury, Joyanta; Lahav, Michal; Zenkina, Olena V.; Diskin-Posner, Yael; Leitus, Gregory; Iron, Mark A.; van der Boom, Milko E.","Palladium-Catalyzed Cross-Coupling Reactions with Fluorinated Substrates: Mechanistic Insights into the Undesired Hydrodehalogenation of Aryl Halides","Organometallics","2012","31","4","1271","","10.1021/om200898t","","","0.71073","MoKα","","0.0561","0.0369","","","0.0769","0.0832","","","","","","1.02","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067905","11.8726","0.0004","16.8581","0.0005","22.9945","0.0008","90","","98.302","0.002","90","","4554.1","0.3","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 F12 K2 N2 O2.5 -","- C14 H15 F12 K2 N2 O2.5 -","- C112 H120 F96 K16 N16 O20 -","8","2","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum?","Organometallics","2012","31","4","1448","","10.1021/om200906e","","x-ray","0.71073","MoKα","","0.0784","0.0435","","","0.1001","0.1124","","","","","","0.962","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4067906","11.1319","0.0005","12.4006","0.0005","14.9455","0.0006","90","","90","","90","","2063.11","0.15","150","2","150","2","","","","","","","synthesis as described","7","P c 21 n","P -2n -2ac","33","","","","- C14 H14 Cl F12 In N2 O2 -","- C14 H14 Cl F12 In N2 O2 -","- C56 H56 Cl4 F48 In4 N8 O8 -","4","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum?","Organometallics","2012","31","4","1448","","10.1021/om200906e","","x-ray","0.71073","MoKα","","0.0146","0.0144","","","0.0374","0.0376","","","","","","1.044","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067907","9.6307","0.0012","17.162","0.002","13.0256","0.0015","90","","105.311","0.004","90","","2076.5","0.4","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 F12 In N2 O2 -","- C15 H17 F12 In N2 O2 -","- C60 H68 F48 In4 N8 O8 -","4","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum?","Organometallics","2012","31","4","1448","","10.1021/om200906e","","x-ray","0.71073","MoKα","","0.0703","0.0429","","","0.1012","0.1159","","","","","","1.029","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067908","11.7277","0.0012","20.942","0.002","11.5897","0.0012","90","","115.141","0.004","90","","2576.8","0.5","150","2","150","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 F12 In Li N2 O2 -","- C20 H26 F12 In Li N2 O2 -","- C80 H104 F48 In4 Li4 N8 O8 -","4","0.5","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum?","Organometallics","2012","31","4","1448","","10.1021/om200906e","","x-ray","0.71073","MoKα","","0.0364","0.0311","","","0.08","0.0853","","","","","","0.68","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067909","18.422","0.004","9.396","0.002","18.534","0.004","90","","116.506","0.008","90","","2870.9","1.1","150","2","150","2","","","","","","","synthesis as described","7","P 1 21/a 1","-P 2yab","14","","","","- C22 H31 F12 In N2 O2 Si -","- C22 H31 F12 In N2 O2 Si -","- C88 H124 F48 In4 N8 O8 Si4 -","4","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Indium Complexes of Fluorinated Dialkoxy-Diimino Salen-like Ligands for Ring-Opening Polymerization ofrac-Lactide: How Does Indium Compare to Aluminum?","Organometallics","2012","31","4","1448","","10.1021/om200906e","","x-ray","0.71073","MoKα","","0.035","0.0283","","","0.0591","0.0615","","","","","","1.098","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067910","17.8298","0.0009","12.4955","0.0007","19.9327","0.0009","90","","113.157","0.002","90","","4083.1","0.4","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Al F6 N O -","- C20 H20 Al F6 N O -","- C160 H160 Al8 F48 N8 O8 -","8","2","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.0909","0.0545","","","0.1154","0.1312","","","","","","1.062","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067911","12.6196","0.0016","7.2451","0.0011","18.583","0.003","90","","93.935","0.008","90","","1695","0.4","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","","","- C15 H18 Al F6 N O -","- C15 H18 Al F6 N O -","- C60 H72 Al4 F24 N4 O4 -","4","1","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.0654","0.047","","","0.09","0.0972","","","","","","1.032","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067912","16.921","","10.286","","20.408","","90","","95.84","","90","","3533.56","","120","2","120","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H35 Al F12 N2 O2 -","- C34 H35 Al F12 N2 O2 -","- C136 H140 Al4 F48 N8 O8 -","4","1","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.1369","0.0692","","","0.1891","0.2301","","","","","","1.04","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067913","28.6061","0.0017","7.9775","0.0004","18.7745","0.0011","90","","128.11","0.002","90","","3371.1","0.3","100","2","100","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H27 Al F12 N2 O2 -","- C35 H27 Al F12 N2 O2 -","- C140 H108 Al4 F48 N8 O8 -","4","0.5","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.0408","0.036","","","0.088","0.091","","","","","","1.047","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067914","19.199","0.002","10.2345","0.0011","20.423","0.002","90","","112.577","0.004","90","","3705.4","0.7","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H39 Al F12 N2 O3 -","- C36 H39 Al F12 N2 O3 -","- C144 H156 Al4 F48 N8 O12 -","4","1","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.1128","0.0866","","","0.2228","0.2408","","","","","","1.103","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067915","9.2914","0.0008","12.461","0.0012","16.2362","0.0015","81.295","0.004","82.018","0.004","84.649","0.004","1835.2","0.3","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C37 H31 Al F12 N2 O3 -","- C37 H31 Al F12 N2 O3 -","- C74 H62 Al2 F24 N4 O6 -","2","1","","Bouyahyi, Miloud; Roisnel, Thierry; Carpentier, Jean-François","Aluminum Complexes of Bidentate Fluorinated Alkoxy-Imino Ligands: Syntheses, Structures, and Use in Ring-Opening Polymerization of Cyclic Esters","Organometallics","2012","31","4","1458","","10.1021/om200907x","","x-ray","0.71073","MoKα","","0.0735","0.0501","","","0.1127","0.1291","","","","","","1.074","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067916","11.9729","0.0004","9.3725","0.0002","12.0227","0.0004","90","","115.386","0.001","90","","1218.87","0.06","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 N O2 Si -","- C11 H13 N O2 Si -","- C44 H52 N4 O8 Si4 -","4","1","","Matt, Benjamin; Moussa, Jamal; Chamoreau, Lise-Marie; Afonso, Carlos; Proust, Anna; Amouri, Hani; Izzet, Guillaume","Elegant Approach to the Synthesis of a Unique Heteroleptic Cyclometalated Iridium(III)-Polyoxometalate Conjugate","Organometallics","2012","31","1","35","","10.1021/om200910p","","","0.71073","MoKα","","0.0547","0.0392","","","0.1061","0.116","","","","","","1.045","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067917","10.4581","0.0003","12.0415","0.0003","13.7808","0.0003","94.737","0.001","93.046","0.001","104.784","0.001","1667.28","0.07","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H36 Ir N3 O3 Si -","- C36.5 H36 Ir N3 O3 Si -","- C73 H72 Ir2 N6 O6 Si2 -","2","1","","Matt, Benjamin; Moussa, Jamal; Chamoreau, Lise-Marie; Afonso, Carlos; Proust, Anna; Amouri, Hani; Izzet, Guillaume","Elegant Approach to the Synthesis of a Unique Heteroleptic Cyclometalated Iridium(III)-Polyoxometalate Conjugate","Organometallics","2012","31","1","35","","10.1021/om200910p","","","0.71073","MoKα","","0.0211","0.0179","","","0.0416","0.0431","","","","","","1.09","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067918","19.1628","0.0015","19.6311","0.0018","4.4177","0.0005","90","","90","","90","","1661.9","0.3","180","2","180","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C26 H36 Au2 N8 Na2 O12 -","- C26 H36 Au2 N8 Na2 O12 -","- C52 H72 Au4 N16 Na4 O24 -","2","0.5","","Cure, Jérémy; Poteau, Romuald; Gerber, Iann C.; Gornitzka, Heinz; Hemmert, Catherine","Dimeric Gold Bis(carbene) Complexes by Transmetalation in Water","Organometallics","2012","31","2","619","","10.1021/om2009183","","","0.71073","MoKα","","0.0531","0.0369","","","0.0658","0.0699","","","","","","1.01","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4067919","15.7363","0.0004","18.6612","0.0004","23.01","0.0006","73.734","0.001","76.808","0.001","89.805","0.001","6302.2","0.3","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C32.67 H54.33 Au2 Br1.45 F3.33 N8.33 O5 P0.56 -","- C32.6667 H54.3333 Au2 Br1.44333 F3.33467 N8.33333 O5 P0.556667 -","- C196 H326 Au12 Br8.66 F20.008 N50 O30 P3.34 -","6","3","","Cure, Jérémy; Poteau, Romuald; Gerber, Iann C.; Gornitzka, Heinz; Hemmert, Catherine","Dimeric Gold Bis(carbene) Complexes by Transmetalation in Water","Organometallics","2012","31","2","619","","10.1021/om2009183","","","0.71073","MoKα","","0.0387","0.0262","","","0.0514","0.0554","","","","","","1.026","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"4067920","11.4734","0.0006","12.8132","0.0005","11.7879","0.0007","90","","96.587","0.002","90","","1721.51","0.15","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H15 Cl N2 O2 Pt -","- C18 H15 Cl N2 O2 Pt -","- C72 H60 Cl4 N8 O8 Pt4 -","4","2","","Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.","Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation","Organometallics","2012","31","1","306","","10.1021/om200922a","","","0.71073","MoKα","","0.0598","0.0442","","","0.0989","0.1077","","","","","","1.031","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067921","8.6788","0.0003","12.8673","0.0004","15.2802","0.0005","69.416","0.002","86.68","0.002","82.83","0.002","1584.77","0.09","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H16 Cl N3 O Pt -","- C17 H16 Cl N3 O Pt -","- C68 H64 Cl4 N12 O4 Pt4 -","4","2","","Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.","Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation","Organometallics","2012","31","1","306","","10.1021/om200922a","","","0.71073","MoKα","","0.0372","0.027","","","0.0589","0.0624","","","","","","1.023","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067922","7.1077","0.0003","10.4427","0.0006","20.5971","0.0009","90","","92.043","0.003","90","","1527.82","0.13","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 Cl N2 O Pt -","- C17 H15 Cl N2 O Pt -","- C68 H60 Cl4 N8 O4 Pt4 -","4","1","","Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.","Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation","Organometallics","2012","31","1","306","","10.1021/om200922a","","","0.71073","MoKα","","0.0685","0.0345","","","0.0632","0.0715","","","","","","0.942","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067923","13.341","0.005","15.255","0.005","9.055","0.005","90","0.005","111.923","0.005","90","0.005","1709.6","1.3","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 F6 N2 O6 Pt S2 -","- C12 H8 F6 N2 O6 Pt S2 -","- C48 H32 F24 N8 O24 Pt4 S8 -","4","0.5","","Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.","Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation","Organometallics","2012","31","1","306","","10.1021/om200922a","","","0.71073","MoKα","","0.0461","0.0349","","","0.0849","0.0933","","","","","","0.771","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4067924","8.7643","0.0008","10.225","0.0007","13.1734","0.0012","94.007","0.007","106.983","0.007","100.868","0.006","1098.95","0.17","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H8 F6 N2 O10 Pt S2 -","- C12 H8 F6 N2 O10 Pt S2 -","- C24 H16 F12 N4 O20 Pt2 S4 -","2","1","","Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J.","Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation","Organometallics","2012","31","1","306","","10.1021/om200922a","","","0.71073","MoKα","","0.077","0.0542","","","0.1174","0.1295","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4067925","17.728","0.009","13.503","0.007","15.199","0.008","90","","108.275","0.007","90","","3455","3","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H35 N3 O6 S3 -","- C34 H35 N3 O6 S3 -","- C136 H140 N12 O24 S12 -","4","1","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.3845","0.0867","","","0.2052","0.3536","","","","","","0.858","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067926","28.676","0.014","14.915","0.007","18.614","0.009","90","","93.087","0.01","90","","7950","7","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H41 N3 O6 S3 -","- C37 H41 N3 O6 S3 -","- C296 H328 N24 O48 S24 -","8","2","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.2965","0.0879","","","0.1873","0.243","","","","","","0.883","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067927","19.242","0.012","10.721","0.007","20.441","0.013","90","","95.836","0.011","90","","4195","5","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H47 N3 O6 S3 -","- C40 H47 N3 O6 S3 -","- C160 H188 N12 O24 S12 -","4","1","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.1204","0.0579","","","0.1574","0.1771","","","","","","0.99","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067928","29.726","0.008","11.085","0.003","24.76","0.007","90","","96.319","0.005","90","","8109","4","300","2","300","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H49 N3 O7 S3 -","- C41 H49 N3 O7 S3 -","- C328 H392 N24 O56 S24 -","8","1","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.1836","0.0703","","","0.171","0.2172","","","","","","1.01","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067929","23.107","0.002","10.9792","0.0007","29.489","0.002","90","","96.16","0.006","90","","7438.1","0.9","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C37.25 H41.5 Cl0.5 N3 O6 S3 -","- C37.25 H41.5 Cl0.5 N3 O6 S3 -","- C298 H332 Cl4 N24 O48 S24 -","8","2","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.2059","0.0713","","","0.171","0.2476","","","","","","0.992","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067930","17.866","0.003","17.866","0.003","9.887","0.003","90","","90","","120","","2733.1","1.1","153","2","153","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C34 H35 Cl2 N3 O6 S3 -","- C33.99 H34.98 Cl2 N3 O6 S3 -","- C101.97 H104.94 Cl6 N9 O18 S9 -","3","0.166667","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.1394","0.0655","","","0.1386","0.1598","","","","","","0.886","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067931","11.6075","0.0009","11.6918","0.0009","21.7115","0.0017","90","","90","","90","","2946.5","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H54 B3 P3 Si -","- C19 H54 B3 P3 Si -","- C76 H216 B12 P12 Si4 -","4","1","","Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos)","Organometallics","2012","31","3","775","","10.1021/om200930k","","","0.71073","MoKα","","0.0391","0.0329","","","0.0756","0.0792","","","","","","1.027","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067932","9.7734","0.0003","11.6223","0.0004","15.3027","0.0005","88.046","0.002","74.705","0.001","82.959","0.001","1664.01","0.09","100","2","100","2","","","","","","","","8","P 1","P 1","1","","","","- C27 H53 F3 O3 P3 Rh S Si -","- C27 H53 F3 O3 P3 Rh S Si -","- C54 H106 F6 O6 P6 Rh2 S2 Si2 -","2","2","","Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos)","Organometallics","2012","31","3","775","","10.1021/om200930k","","","0.71073","MoKα","","0.0303","0.0284","","","0.0706","0.0721","","","","","","1.036","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067933","14.4","0.005","14.632","0.005","15.237","0.005","90","","90","","90","","3210.4","1.9","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H47 Cl4 Cu2 P3 Si -","- C20 H47 Cl4 Cu2 P3 Si -","- C80 H188 Cl16 Cu8 P12 Si4 -","4","1","","Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos)","Organometallics","2012","31","3","775","","10.1021/om200930k","","","0.71073","MoKα","","0.0411","0.0339","","","0.0723","0.0767","","","","","","1.019","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067934","25.5296","0.0015","25.5296","0.0015","25.5296","0.0015","90","","90","","90","","16639.2","1.7","100","2","100","2","","","","","","","","9","P 21 3","P 2ac 2ab 3","198","","","","- C27 H43 F6 N3 O6 P3 Ru S2 Si -","- C26.5 H42.99 F4.5 N3 O4.5 P3 Ru S1.5 Si -","- C424 H687.84 F72 N48 O72 P48 Ru16 S24 Si16 -","16","1.33333","","Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos)","Organometallics","2012","31","3","775","","10.1021/om200930k","","","0.71073","MoKα","","0.0709","0.0603","","","0.1475","0.1535","","","","","","1.001","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067935","11.7497","0.0003","11.7497","0.0003","10.9259","0.0003","90","","90","","120","","1306.3","0.06","100","2","100","2","","","","","","","","6","P 63","P 6c","173","","","","- C19 H45 Cl3 P3 Ru Si -","- C19 H45 Cl3 P3 Ru Si -","- C38 H90 Cl6 P6 Ru2 Si2 -","2","0.333333","","Cain, Matthew F.; Glueck, David S.; Golen, James A.; Rheingold, Arnold L.","Asymmetric Synthesis and Metal Complexes of aC3-Symmetric P-Stereogenic Triphosphine, (R)-MeSi(CH2PMe(t-Bu))3(MT-Siliphos)","Organometallics","2012","31","3","775","","10.1021/om200930k","","","0.71073","MoKα","","0.0335","0.0297","","","0.0756","0.0777","","","","","","1.031","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067936","17.3499","0.0013","6.9681","0.0003","16.2041","0.0013","90","","115.088","0.002","90","","1774.2","0.2","295","","295","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","LiB(C6H5)4","lithium tetraphenylborate at 295 K","","- C24 H20 B Li -","- C24 H20 B Li -","- C96 H80 B4 Li4 -","4","0.5","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067937","17.2196","0.0012","6.9182","0.0004","16.1249","0.0012","90","","115.016","0.003","90","","1740.7","0.2","193","","193","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","LiB(C6H5)4","lithium tetraphenylborate at 193 K","","- C24 H20 B Li -","- C24 H20 B Li -","- C96 H80 B4 Li4 -","4","0.5","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","powder diffraction","x-ray","1.78896","CoKα~2~","","","","","","","","","","","","","","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067938","11.477","0.001","11.477","0.001","7.4405","0.0014","90","","90","","90","","980.1","0.2","295","","295","","","","","","","","","4","I -4 2 m","I -4 2","121","NaB(C6H5)4","Sodium tetraphenylborate at 295 K","","- C24 H20 B Na -","- C24 H20 B Na -","- C48 H40 B2 Na2 -","2","0.125","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","","","0.71073","MoKα","","0.0365","0.0359","","","0.1032","0.1037","","","","","","1.002","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067939","7.3252","0.0016","16.291","0.004","15.763","0.004","90","","102.173","0.007","90","","1838.8","0.8","90","","90","","","","","","","","","4","C 1 c 1","C -2yc","9","NaB(C6H5)4","Sodium tetraphenylborate at 90 K","","- C24 H20 B Na -","- C24 H20 B Na -","- C96 H80 B4 Na4 -","4","1","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","","","0.71073","MoKα","","0.1005","0.0887","","","0.2336","0.2505","","","","","","1.002","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067940","11.1556","0.0006","11.1556","0.0006","8.0534","0.0007","90","","90","","90","","1002.22","0.12","153","","153","","","","","","","","","4","I -4 2 m","I -4 2","121","RbB(C6H5)4","Rubidium tetraphenylborate at 153 K","","- C24 H20 B Rb -","- C24 H20 B Rb -","- C48 H40 B2 Rb2 -","2","0.125","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","","","0.71073","MoKα","","0.0269","0.0269","","","0.0671","0.0671","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067941","11.2847","0.0004","11.2847","0.0004","8.4248","0.0007","90","","90","","90","","1072.85","0.1","295","","295","","","","","","","","","4","I -4 2 m","I -4 2","121","CsB(C6H5)4","Cesium tetraphenylborate at 295 K","","- C24 H20 B Cs -","- C24 H20 B Cs -","- C48 H40 B2 Cs2 -","2","0.125","","Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk","Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs)","Organometallics","2012","31","3","905","","10.1021/om200943n","","","0.71073","MoKα","","0.021","0.0184","","","0.0407","0.0418","","","","","","1.001","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067942","13.761","0.0004","17.2858","0.0005","39.9274","0.0012","90","","90","","90","","9497.5","0.5","110","","110","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C37 H62 Au2 Cl2 F12 P2 Sb2 -","- C37 H62 Au2 Cl2 F12 P2 Sb2 -","- C296 H496 Au16 Cl16 F96 P16 Sb16 -","8","1","","Brooner, Rachel E. M.; Widenhoefer, Ross A.","Synthesis and Structure of Dicationic, Bis(gold) π-Alkene Complexes Containing a 2,2′-Bis(phosphino)biphenyl Ligand","Organometallics","2012","31","2","768","","10.1021/om200948z","","","0.71073","MoKα","","0.0918","0.0529","","","0.1268","0.1453","","","","","","1.085","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067943","19.0763","0.0006","15.7558","0.0005","16.9063","0.0005","90","","93.1807","0.0018","90","","5073.6","0.3","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H65 Au2 Cl2 F12 P2 Sb2 -","- C39 H65 Au2 Cl2 F12 P2 Sb2 -","- C156 H260 Au8 Cl8 F48 P8 Sb8 -","4","1","","Brooner, Rachel E. M.; Widenhoefer, Ross A.","Synthesis and Structure of Dicationic, Bis(gold) π-Alkene Complexes Containing a 2,2′-Bis(phosphino)biphenyl Ligand","Organometallics","2012","31","2","768","","10.1021/om200948z","","","0.71073","MoKα","","0.1178","0.0716","","","0.1693","0.1817","","","","","","1.075","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067944","8.1288","0.0003","21.5156","0.0006","12.9148","0.0004","90","","95.866","0.003","90","","2246.92","0.13","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H29 B F4 I N P Rh -","- C18 H29 B F4 I N P Rh -","- C72 H116 B4 F16 I4 N4 P4 Rh4 -","4","1","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0372","0.0296","","","0.0681","0.0699","","","","","","1.114","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067945","9.4279","0.0004","13.1022","0.0005","18.0704","0.0007","90","","99.886","0.002","90","","2199.02","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 F9 I P Rh -","- C17 H24 F9 I P Rh -","- C68 H96 F36 I4 P4 Rh4 -","4","1","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0203","0.019","","","0.0456","0.0462","","","","","","1.038","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067946","12.4747","0.0004","13.3277","0.0005","15.0019","0.0005","70.372","0.002","66.215","0.002","66.821","0.002","2051.06","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H38 D6 F14 I2 Rh2 -","- C36 H44 F14 I2 Rh2 -","- C72 H88 F28 I4 Rh4 -","2","1","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0429","0.0355","","","0.0747","0.0781","","","","","","1.057","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067947","16.6976","0.0011","13.5697","0.0009","16.8812","0.0011","90","","103.331","0.002","90","","3721.9","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 F10 O5 P Rh S -","- C36 H34 F10 O5 P Rh S -","- C144 H136 F40 O20 P4 Rh4 S4 -","4","1","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0499","0.047","","","0.113","0.1149","","","","","","1.064","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067948","17.4942","0.0015","10.784","0.0009","13.5254","0.0012","90","","107.105","0.002","90","","2438.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 F9 I P Rh -","- C19 H28 F9 I P Rh -","- C76 H112 F36 I4 P4 Rh4 -","4","1","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0401","0.0371","","","0.0727","0.0739","","","","","","1.192","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067949","14.6027","0.0014","8.1396","0.0008","16.9438","0.0016","90","","103.877","0.002","90","","1955.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H38 F18 I2 Rh2 -","- C32 H38 F18 I2 Rh2 -","- C64 H76 F36 I4 Rh4 -","2","0.5","","Gil-Rubio, Juan; Guerrero-Leal, Juan; Blaya, María; Vicente, José; Bautista, Delia; Jones, Peter G.","Reactions of Half-Sandwich Ethene Complexes of Rhodium(I) toward Iodoperfluorocarbons: Perfluoro-alkylation or -arylation of Coordinated Ethene versus Oxidative Addition","Organometallics","2012","31","4","1287","","10.1021/om2009588","","","0.71073","MoKα","","0.0518","0.0433","","","0.1038","0.1081","","","","","","1.092","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067950","17.6074","0.0007","15.0201","0.0006","9.1566","0.0004","90","","90","","90","","2421.6","0.17","200","2","200","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ta-complex","","- C22 H41 N3 Ta -","- C22 H41 N3 Ta -","- C88 H164 N12 Ta4 -","4","0.5","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0249","0.0231","","","0.0486","0.0495","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067951","9.5193","0.0006","15.1552","0.0009","17.9819","0.0011","90","","98.17","0.001","90","","2567.9","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ta-complex","","- C23 H44 N4 Ta -","- C23 H44 N4 Ta -","- C92 H176 N16 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0295","0.023","","","0.0471","0.0484","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067952","8.747","0.0004","18.1399","0.0009","15.7496","0.0008","90","","96.2647","0.0008","90","","2484.1","0.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H42 Cl N3 Ta -","- C22 H42 Cl N3 Ta -","- C88 H168 Cl4 N12 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0174","0.0162","","","0.0346","0.0349","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067953","10.9966","0.0003","14.0571","0.0004","15.5254","0.0005","90","","100.078","0.0004","90","","2362.89","0.12","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H41 N3 Ta -","- C22 H41 N3 Ta -","- C88 H164 N12 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0152","0.0134","","","0.0292","0.0297","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067954","9.1072","0.0006","16.522","0.0012","17.989","0.0014","90","","103.646","0.001","90","","2630.4","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H45 Cl N4 Ta -","- C23 H45 Cl N4 Ta -","- C92 H180 Cl4 N16 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.034","0.0205","","","0.0389","0.0417","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067955","8.8396","0.0006","33.469","0.002","8.8946","0.0006","90","","103.232","0.0009","90","","2561.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H44 Cl N4 Ta -","- C23 H44 Cl N4 Ta -","- C92 H176 Cl4 N16 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0289","0.027","","","0.0579","0.0588","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067956","8.8694","0.0005","16.3518","0.0009","18.3329","0.001","90","","96.2652","0.0008","90","","2643","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23.88 H46.64 I0.12 N4 Ta -","- C23.8797 H46.6391 I0.1203 N4 Ta -","- C95.5188 H186.556 I0.4812 N16 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0222","0.0204","","","0.0436","0.0442","","","","","","1","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067957","16.6809","0.0014","9.2788","0.0008","17.6464","0.0015","90","","91.054","0.001","90","","2730.8","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23.16 H44.47 I0.84 N4 Ta -","- C23.1571 H44.4713 I0.8429 N4 Ta -","- C92.6284 H177.885 I3.3716 N16 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0217","0.0203","","","0.0446","0.0451","","","","","","1","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067958","9.5135","0.0008","16.9058","0.0015","19.2328","0.0017","90","","103.888","0.001","90","","3002.8","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H49 N4 S Ta -","- C29 H49 N4 S Ta -","- C116 H196 N16 S4 Ta4 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0182","0.0163","","","0.0349","0.0355","","","","","","1.001","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067959","13.3696","0.0016","13.9845","0.0017","25.723","0.003","90","","90","","90","","4809.4","1","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C48 H74 N6 S2 Ta2 -","- C48 H74 N6 S2 Ta2 -","- C192 H296 N24 S8 Ta8 -","4","1","","Yonke, Brendan L.; Keane, Andrew J.; Zavalij, Peter Y.; Sita, Lawrence R.","Mononuclear Tantalum(IV, d1) Imido Complexes Supported by the Monocyclopentadienyl, Amidinate and Guanidinate Ligand Sets As Models to Explore Dinitrogen Fixation by “End-On-Bridged” Dinuclear {[Ta(IV, d1)]}2(μ-η1:η1-N2) Complexes","Organometallics","2012","31","1","345","","10.1021/om200961r","","","0.71073","MoKα","","0.0177","0.0168","","","0.0352","0.0355","","","","","","1","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067960","10.767","0.006","6.462","0.003","19.365","0.008","90","","95.621","0.006","90","","1340.9","1.1","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 N2 -","- C17 H18 N2 -","- C68 H72 N8 -","4","1","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","x-ray","0.71073","MoKα","","0.0964","0.05","","","0.114","0.1492","","","","","","1.047","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067961","8.832","0.004","14.909","0.006","17.469","0.008","113.286","0.012","93.244","0.016","100.35","0.012","2057.7","1.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H29 N2 Rh -","- C25 H29 N2 Rh -","- C100 H116 N8 Rh4 -","4","2","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","x-ray","0.71073","MoKα","","0.0887","0.0425","","","0.0816","0.1025","","","","","","1.034","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067962","11.733","0.005","18.595","0.008","7.615","0.004","90","","107.497","0.01","90","","1584.5","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 Cl2 N2 Rh -","- C17 H17 Cl2 N2 Rh -","- C68 H68 Cl8 N8 Rh4 -","4","1","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","x-ray","0.71073","MoKα","","0.0328","0.0246","","","0.0614","0.068","","","","","","1.103","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067963","7.1389","0.0008","7.9099","0.0009","16.69","0.002","102.821","0.002","93.491","0.002","94.109","0.002","913.73","0.18","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H14 Cl3 N2 O Rh -","- C19 H14 Cl3 N2 O Rh -","- C38 H28 Cl6 N4 O2 Rh2 -","2","1","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","x-ray","0.71073","MoKα","","0.0459","0.0342","","","0.0749","0.0793","","","","","","1.076","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067964","12.515","0.001","18.619","0.002","15.015","0.002","90","","111.514","0.003","90","","3255","0.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H24 Cl2 N4 O3 Rh2 -","- C38 H24 Cl2 N4 O3 Rh2 -","- C152 H96 Cl8 N16 O12 Rh8 -","4","0.5","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","","0.71073","MoKα","","0.0682","0.0415","","","0.0947","0.1121","","","","","","1.046","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067965","9.897","0.0006","10.9397","0.0007","12.2543","0.0008","109.847","0.001","95.505","0.001","96.594","0.001","1226.72","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H27 Cl3 N2 O2 Zr -","- C25 H27 Cl3 N2 O2 Zr -","- C50 H54 Cl6 N4 O4 Zr2 -","2","1","","Sieb, David; Schuhen, Katrin; Morgen, Michael; Herrmann, Heike; Wadepohl, Hubert; Lucas, Nigel T.; Baker, Robert W.; Enders, Markus","Synthesis and Complexation Behavior of Indenyl and Cyclopentadienyl Ligands Functionalized with a Naphthyridine Unit","Organometallics","2012","31","1","356","","10.1021/om2009638","","x-ray","0.71073","MoKα","","0.0312","0.0265","","","0.068","0.0719","","","","","","1.041","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067966","7.8478","0.0002","9.1844","0.0003","15.555","0.0005","75.848","0.001","79.524","0.001","89.988","0.001","1067.86","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","in manuscript 3","","","- C18 H19 Br2 Cl2 N3 Pt -","- C18 H19 Br2 Cl2 N3 Pt -","- C36 H38 Br4 Cl4 N6 Pt2 -","2","1","","Cao, Peng; Cabrera, José; Padilla, Robin; Serra, Daniel; Rominger, Frank; Limbach, Michael","Hydroamination of Unactivated Alkenes Catalyzed by Novel Platinum(II)N-Heterocyclic Carbene Complexes","Organometallics","2012","31","3","921","","10.1021/om200964u","","","0.71073","MoKα","","0.0291","0.0233","","","0.0523","0.0545","","","","","","1.058","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067967","8.6922","0.0007","30.19","0.003","15.5621","0.0013","90","","98.568","0.002","90","","4038.2","0.6","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","in manuscript 4","","","- C18.5 H20 Br2 Cl N3 Pt -","- C18.5 H20 Br2 Cl N3 Pt -","- C148 H160 Br16 Cl8 N24 Pt8 -","8","2","","Cao, Peng; Cabrera, José; Padilla, Robin; Serra, Daniel; Rominger, Frank; Limbach, Michael","Hydroamination of Unactivated Alkenes Catalyzed by Novel Platinum(II)N-Heterocyclic Carbene Complexes","Organometallics","2012","31","3","921","","10.1021/om200964u","","","0.71073","MoKα","","0.0356","0.0277","","","0.0571","0.0593","","","","","","1.074","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067968","11.3575","0.0005","13.0886","0.0006","14.5169","0.0007","89.591","0.001","73.009","0.001","73.607","0.001","1973.21","0.16","200","2","200","2","","","","","","","","7","P -1","-P 1","2","10 in manuscript","","","- C39 H51 B F4 N6 O2 Pt -","- C39 H51 B F4 N6 O2 Pt -","- C78 H102 B2 F8 N12 O4 Pt2 -","2","1","","Cao, Peng; Cabrera, José; Padilla, Robin; Serra, Daniel; Rominger, Frank; Limbach, Michael","Hydroamination of Unactivated Alkenes Catalyzed by Novel Platinum(II)N-Heterocyclic Carbene Complexes","Organometallics","2012","31","3","921","","10.1021/om200964u","","","0.71073","MoKα","","0.0969","0.0577","","","0.1157","0.13","","","","","","0.992","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067969","10.3723","0.0008","16.4418","0.0015","23.513","0.002","90","","99.872","0.003","90","","3950.5","0.6","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H61 As Ge Se1.11 -","- C38.002 H61 As Ge Se1.11 -","- C152.008 H244 As4 Ge4 Se4.44 -","4","1","","Ghereg, Dumitru; Sotiropoulos, Jean-Marc; Escudié, Jean; Miqueu, Karinne; Matioszek, Dimitri; Ladeira, Sonia; Saffon-Merceron, Nathalie","Versatile 1,2- and 1,3-Dipole Behavior of the 1-Arsa-3-Germaallene Tip(t-Bu)Ge═C═AsMes*: Formation of a Heterocyclic Arsa(germa)carbene (AsGeHC)","Organometallics","2012","31","3","930","","10.1021/om200968x","","","0.71073","MoKα","","0.0413","0.0308","","","0.0724","0.0779","","","","","","1.026","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067970","10.1766","0.001","12.5486","0.0012","20.381","0.002","77.202","0.004","85.813","0.004","82.062","0.004","2511.3","0.4","193","2","193","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C55 H79 As Ge O2 -","- C55 H79 As Ge O2 -","- C110 H158 As2 Ge2 O4 -","2","1","","Ghereg, Dumitru; Sotiropoulos, Jean-Marc; Escudié, Jean; Miqueu, Karinne; Matioszek, Dimitri; Ladeira, Sonia; Saffon-Merceron, Nathalie","Versatile 1,2- and 1,3-Dipole Behavior of the 1-Arsa-3-Germaallene Tip(t-Bu)Ge═C═AsMes*: Formation of a Heterocyclic Arsa(germa)carbene (AsGeHC)","Organometallics","2012","31","3","930","","10.1021/om200968x","","x-ray","0.71073","MoKα","","0.0585","0.0365","","","0.0784","0.0866","","","","","","1.006","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067971","11.0351","0.0005","12.2305","0.0006","20.1455","0.001","98.138","0.001","100.002","0.001","105.776","0.001","2525.1","0.2","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C51.5 H83 As Ge N O -","- C51.5 H83 As Ge N O -","- C103 H166 As2 Ge2 N2 O2 -","2","1","","Ghereg, Dumitru; Sotiropoulos, Jean-Marc; Escudié, Jean; Miqueu, Karinne; Matioszek, Dimitri; Ladeira, Sonia; Saffon-Merceron, Nathalie","Versatile 1,2- and 1,3-Dipole Behavior of the 1-Arsa-3-Germaallene Tip(t-Bu)Ge═C═AsMes*: Formation of a Heterocyclic Arsa(germa)carbene (AsGeHC)","Organometallics","2012","31","3","930","","10.1021/om200968x","","","0.71073","MoKα","","0.0738","0.0413","","","0.0931","0.1056","","","","","","1.003","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4067972","10.0231","0.0005","31.4407","0.0017","18.7805","0.0009","90","","118.019","0.003","90","","5224.7","0.5","180","2","180","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H70 As Cl3 Ge O2 -","- C53 H70 As Cl3 Ge O2 -","- C212 H280 As4 Cl12 Ge4 O8 -","4","1","","Ghereg, Dumitru; Sotiropoulos, Jean-Marc; Escudié, Jean; Miqueu, Karinne; Matioszek, Dimitri; Ladeira, Sonia; Saffon-Merceron, Nathalie","Versatile 1,2- and 1,3-Dipole Behavior of the 1-Arsa-3-Germaallene Tip(t-Bu)Ge═C═AsMes*: Formation of a Heterocyclic Arsa(germa)carbene (AsGeHC)","Organometallics","2012","31","3","930","","10.1021/om200968x","","x-ray","0.71073","MoKα","","0.0654","0.0486","","","0.1229","0.1334","","","","","","1.021","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067973","9.925","0.0006","23.8454","0.0015","22.0595","0.0013","90","","99.647","0.003","90","","5146.9","0.5","193","2","193","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C52 H71 As Ge O2 -","- C52 H71 As Ge O2 -","- C208 H284 As4 Ge4 O8 -","4","2","","Ghereg, Dumitru; Sotiropoulos, Jean-Marc; Escudié, Jean; Miqueu, Karinne; Matioszek, Dimitri; Ladeira, Sonia; Saffon-Merceron, Nathalie","Versatile 1,2- and 1,3-Dipole Behavior of the 1-Arsa-3-Germaallene Tip(t-Bu)Ge═C═AsMes*: Formation of a Heterocyclic Arsa(germa)carbene (AsGeHC)","Organometallics","2012","31","3","930","","10.1021/om200968x","","x-ray","0.71073","MoKα","","0.1283","0.0966","","","0.2415","0.2627","","","","","","1.096","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4067974","14.818","0.002","9.6743","0.0012","19.402","0.003","90","","104.771","0.0018","90","","2689.4","0.6","200","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H31 O2 P Ru -","- C33 H28 O2 P Ru -","- C132 H112 O8 P4 Ru4 -","4","1","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0479","","","","0.1492","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067975","11.841","0.0006","9.9843","0.0005","30.037","0.002","90","","97.753","0.004","90","","3518.6","0.3","200","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H33 O P Ru -","- C38 H33 O P Ru -","- C152 H132 O4 P4 Ru4 -","4","1","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0541","","","","0.1908","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067976","14.794","0.003","9.6171","0.0018","19.264","0.004","90","","104.841","0.003","90","","2649.4","0.9","200","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H28 Br O P Ru -","- C32 H28 Br O P Ru -","- C128 H112 Br4 O4 P4 Ru4 -","4","1","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0452","","","","0.1413","","","","","","0.941","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067977","14.776","0.004","9.721","0.002","19.162","0.005","90","","105.616","0.004","90","","2650.8","1.1","200","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H28 N O3 P Ru -","- C32 H28 N O3 P Ru -","- C128 H112 N4 O12 P4 Ru4 -","4","1","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0494","","","","0.1036","","","","","","0.806","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067978","16.8913","0.0015","10.7861","0.001","14.4438","0.0013","90","","90","","90","","2631.5","0.4","200","","","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C33 H31 O P Ru -","- C33 H31 O P Ru -","- C132 H124 O4 P4 Ru4 -","4","1","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0267","","","","0.0766","","","","","","0.835","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067979","20.4154","0.0005","14.0039","0.0004","20.9509","0.0006","90","","93.3277","0.0017","90","","5979.7","0.3","200","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H33 O P Ru -","- C38 H33 O P Ru -","- C304 H264 O8 P8 Ru8 -","8","2","","Hirano, Masafumi; Murakami, Masahiro; Kuga, Toshinori; Komine, Nobuyuki; Komiya, Sanshiro","Acid-Promoted sp3C‒H Bond Cleavage in a Series of (2-Allylphenoxo)ruthenium(II) Complexes. Mechanistic Insight into the Aryloxo‒Acid Interaction and Bond Cleavage Reaction","Organometallics","2012","31","1","381","","10.1021/om200974c","","","0.71075","MoKα","","","0.0437","","","","0.1122","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4067980","18.316","0.001","19.001","0.002","19.963","0.002","90","","113.933","0.002","90","","6350.2","1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H35 F Ni P2 -","- C20 H35 F Ni P2 -","- C240 H420 F12 Ni12 P24 -","12","3","","Mart\?ínez-Prieto, Luis Miguel; Melero, Cristóbal; del R\?ío, Diego; Palma, Pilar; Cámpora, Juan; Álvarez, Eleuterio","Synthesis and Reactivity of Nickel and Palladium Fluoride Complexes with PCP Pincer Ligands. NMR-Based Assessment of Electron-Donating Properties of Fluoride and Other Monoanionic Ligands","Organometallics","2012","31","4","1425","","10.1021/om2009793","","","0.71073","MoKα","","0.1168","0.0679","","","0.1428","0.1647","","","","","","1.003","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067981","18.038","0.004","18.938","0.005","20.036","0.005","90","","113.393","0.004","90","","6282","3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Ni P2 -","- C20 H36 Ni P2 -","- C240 H432 Ni12 P24 -","12","3","","Mart\?ínez-Prieto, Luis Miguel; Melero, Cristóbal; del R\?ío, Diego; Palma, Pilar; Cámpora, Juan; Álvarez, Eleuterio","Synthesis and Reactivity of Nickel and Palladium Fluoride Complexes with PCP Pincer Ligands. NMR-Based Assessment of Electron-Donating Properties of Fluoride and Other Monoanionic Ligands","Organometallics","2012","31","4","1425","","10.1021/om2009793","","","0.71073","MoKα","","0.1099","0.0707","","","0.1611","0.1879","","","","","","1.041","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067982","10.998","0.009","13.794","0.009","28.9","0.03","90","","96.038","0.014","90","","4360","6","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H38 Ni P2 -","- C21 H38 Ni P2 -","- C168 H304 Ni8 P16 -","8","2","","Mart\?ínez-Prieto, Luis Miguel; Melero, Cristóbal; del R\?ío, Diego; Palma, Pilar; Cámpora, Juan; Álvarez, Eleuterio","Synthesis and Reactivity of Nickel and Palladium Fluoride Complexes with PCP Pincer Ligands. NMR-Based Assessment of Electron-Donating Properties of Fluoride and Other Monoanionic Ligands","Organometallics","2012","31","4","1425","","10.1021/om2009793","","","1.54178","CuKα","","0.0586","0.0476","","","0.1159","0.1224","","","","","","0.997","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067983","10.4777","0.001","13.9169","0.0014","18.1873","0.0018","81.963","0.002","76.658","0.001","77.812","0.002","2510.7","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H40 Ni P2 -","- C26 H40 Ni P2 -","- C104 H160 Ni4 P8 -","4","2","","Mart\?ínez-Prieto, Luis Miguel; Melero, Cristóbal; del R\?ío, Diego; Palma, Pilar; Cámpora, Juan; Álvarez, Eleuterio","Synthesis and Reactivity of Nickel and Palladium Fluoride Complexes with PCP Pincer Ligands. NMR-Based Assessment of Electron-Donating Properties of Fluoride and Other Monoanionic Ligands","Organometallics","2012","31","4","1425","","10.1021/om2009793","","","0.71073","MoKα","","0.056","0.0383","","","0.0708","0.0745","","","","","","0.835","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067984","13.5036","0.0011","12.3747","0.0011","14.2276","0.0012","90","","107.045","0.002","90","","2273","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H40 O3 P2 -","- C21 H40 O3 P2 -","- C84 H160 O12 P8 -","4","1","","Mart\?ínez-Prieto, Luis Miguel; Melero, Cristóbal; del R\?ío, Diego; Palma, Pilar; Cámpora, Juan; Álvarez, Eleuterio","Synthesis and Reactivity of Nickel and Palladium Fluoride Complexes with PCP Pincer Ligands. NMR-Based Assessment of Electron-Donating Properties of Fluoride and Other Monoanionic Ligands","Organometallics","2012","31","4","1425","","10.1021/om2009793","","","0.71073","MoKα","","0.0787","0.047","","","0.0687","0.0743","","","","","","0.98","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4067985","20.229","0.003","14.609","0.002","11.919","0.002","90","","119.72","0.03","90","","3059","1.2","203","2","203","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Bis-{1,3-di(isopropyl)-imidazolin-2-ylidene}(hydrido) (heptafluorotolnyl)nickel(II)","","- C25 H35 F7 N4 Ni -","- C25 H35 F7 N4 Ni -","- C100 H140 F28 N16 Ni4 -","4","0.5","","Fischer, Peter; Götz, Kathrin; Eichhorn, Antonius; Radius, Udo","Decisive Steps of the Hydrodefluorination of Fluoroaromatics using [Ni(NHC)2]","Organometallics","2012","31","4","1374","","10.1021/om2009815","","","0.71073","MoKα","","0.1056","0.0706","","","0.1642","0.1861","","","","","","1.097","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4067986","6.1807","0.0002","13.8148","0.0005","10.7253","0.0004","90","","99.377","0.002","90","","903.54","0.06","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C5 H12 F5 N2 P -","- C5 H12 F5 N2 P -","- C20 H48 F20 N8 P4 -","4","1","","Böttcher, Tobias; Shyshkov, Oleg; Bremer, Matthias; Bassil, Bassem S.; Röschenthaler, Gerd-Volker","Carbene Complexes of Phosphorus(V) Fluorides by Oxidative Addition of 2,2-Difluorobis(dialkylamines) to Phosphorus(III) Halides","Organometallics","2012","31","4","1278","","10.1021/om2009827","","","0.71073","MoKα","","0.0267","0.0247","","","0.0614","0.0632","","","","","","1.011","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067987","8.1994","0.001","9.3389","0.0011","12.4262","0.0015","90","","105.505","0.006","90","","916.89","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H13 F4 N2 P -","- C6 H13 F4 N2 P -","- C24 H52 F16 N8 P4 -","4","1","","Böttcher, Tobias; Shyshkov, Oleg; Bremer, Matthias; Bassil, Bassem S.; Röschenthaler, Gerd-Volker","Carbene Complexes of Phosphorus(V) Fluorides by Oxidative Addition of 2,2-Difluorobis(dialkylamines) to Phosphorus(III) Halides","Organometallics","2012","31","4","1278","","10.1021/om2009827","","","0.71073","MoKα","","0.0548","0.0433","","","0.1269","0.1432","","","","","","1.011","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067988","7.547","0.001","10.967","0.001","15.05","0.002","90","","101.15","0.01","90","","1222.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 F4 N2 P -","- C11 H15 F4 N2 P -","- C44 H60 F16 N8 P4 -","4","1","","Böttcher, Tobias; Shyshkov, Oleg; Bremer, Matthias; Bassil, Bassem S.; Röschenthaler, Gerd-Volker","Carbene Complexes of Phosphorus(V) Fluorides by Oxidative Addition of 2,2-Difluorobis(dialkylamines) to Phosphorus(III) Halides","Organometallics","2012","31","4","1278","","10.1021/om2009827","","","0.71073","MoKα","","0.0541","0.0482","","","0.1282","0.1342","","","","","","1.007","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067989","7.594","0.001","9.732","0.002","11.589","0.002","90","","97.8","0.01","90","","848.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H10 F5 N2 P -","- C5 H10 F5 N2 P -","- C20 H40 F20 N8 P4 -","4","1","","Böttcher, Tobias; Shyshkov, Oleg; Bremer, Matthias; Bassil, Bassem S.; Röschenthaler, Gerd-Volker","Carbene Complexes of Phosphorus(V) Fluorides by Oxidative Addition of 2,2-Difluorobis(dialkylamines) to Phosphorus(III) Halides","Organometallics","2012","31","4","1278","","10.1021/om2009827","","","0.71073","MoKα","","0.054","0.0473","","","0.1326","0.1373","","","","","","1.028","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067990","10.6002","0.0006","15.8393","0.0005","26.9465","0.0012","90","","93.51","0.005","90","","4515.8","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H8 N2 O9 Ru3 -","- C21 H8 N2 O9 Ru3 -","- C168 H64 N16 O72 Ru24 -","8","1","","Cabeza, Javier A.; García-Álvarez, Pablo; Pruneda, Vanessa","Reaction of [Ru3(CO)12] with Phenazine: Synthesis of C-Metalated Derivatives That Formally Arise from a C‒H Oxidative Addition or a Long-Distance C-to-N Prototropy","Organometallics","2012","31","3","941","","10.1021/om200983a","","","1.5418","CuKα","","0.1024","0.0573","","","0.0992","0.1229","","","","","","0.926","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067991","10.0952","0.0004","11.9576","0.0007","12.6553","0.0007","103.652","0.005","110.86","0.004","90.282","0.004","1380.54","0.13","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H10 Cl2 N2 O11 Ru4 -","- C24 H10 Cl2 N2 O11 Ru4 -","- C48 H20 Cl4 N4 O22 Ru8 -","2","1","","Cabeza, Javier A.; García-Álvarez, Pablo; Pruneda, Vanessa","Reaction of [Ru3(CO)12] with Phenazine: Synthesis of C-Metalated Derivatives That Formally Arise from a C‒H Oxidative Addition or a Long-Distance C-to-N Prototropy","Organometallics","2012","31","3","941","","10.1021/om200983a","","","1.5418","CuKα","","0.0558","0.0472","","","0.1243","0.1317","","","","","","1.002","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067992","9.4598","0.0001","14.672","0.0001","27.4455","0.0002","90","","97.234","0.001","90","","3778.95","0.06","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H22 N2 O15 Ru6 -","- C33 H22 N2 O15 Ru6 -","- C132 H88 N8 O60 Ru24 -","4","1","","Cabeza, Javier A.; García-Álvarez, Pablo; Pruneda, Vanessa","Reaction of [Ru3(CO)12] with Phenazine: Synthesis of C-Metalated Derivatives That Formally Arise from a C‒H Oxidative Addition or a Long-Distance C-to-N Prototropy","Organometallics","2012","31","3","941","","10.1021/om200983a","","","1.5418","CuKα","","0.0507","0.0445","","","0.1137","0.1186","","","","","","1.052","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067993","9.6575","0.0003","11.7113","0.0004","17.8592","0.0005","97.498","0.002","101.513","0.002","101.856","0.001","1905.82","0.11","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","pentafluoropropenyltriphenyltin","","- C21 H15 F5 Sn -","- C21 H15 F5 Sn -","- C84 H60 F20 Sn4 -","4","2","","Brisdon, Alan K.; Pritchard, Robin G.; Thomas, Anthony","Pentafluoropropenyl Complexes of Mercury, Germanium, Tin, and Lead Derived from (Z)-CFH═CFCF3and Their Use as Transfer Reagents","Organometallics","2012","31","4","1341","","10.1021/om2009843","","x-ray","0.71073","MoKα","","0.0737","0.0612","","","0.1221","0.1313","","","","","","1.168","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067994","9.6608","0.0003","10.266","0.0003","11.7404","0.0004","109.356","0.001","95.807","0.002","115.144","0.002","953.72","0.06","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","pentafluoropropenyltriphenylgermanium","","- C21 H15 F5 Ge -","- C21 H15 F5 Ge -","- C42 H30 F10 Ge2 -","2","1","","Brisdon, Alan K.; Pritchard, Robin G.; Thomas, Anthony","Pentafluoropropenyl Complexes of Mercury, Germanium, Tin, and Lead Derived from (Z)-CFH═CFCF3and Their Use as Transfer Reagents","Organometallics","2012","31","4","1341","","10.1021/om2009843","","x-ray","0.71073","MoKα","","0.0797","0.0584","","","0.1422","0.1578","","","","","","1.079","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4067995","10.8847","0.0004","16.2766","0.0005","18.3614","0.0006","90","","95.684","0.002","90","","3237.02","0.19","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H45 Br O P2 Pd -","- C33 H45 Br O P2 Pd -","- C132 H180 Br4 O4 P8 Pd4 -","4","1","","Bakhmutov, Vladimir I.; Bozoglian, Fernando; Gómez, Kerman; González, Gabriel; Grushin, Vladimir V.; Macgregor, Stuart A.; Martin, Eddy; Miloserdov, Fedor M.; Novikov, Maxim A.; Panetier, Julien A.; Romashov, Leonid V.","CF3‒Ph Reductive Elimination from [(Xantphos)Pd(CF3)(Ph)]","Organometallics","2012","31","4","1315","","10.1021/om200985g","","","0.71073","MoKα","","0.0552","0.0383","","","0.0888","0.0989","","","","","","1.076","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067996","12.6374","0.0003","14.7325","0.0004","22.2696","0.0006","90","","90","","90","","4146.17","0.19","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H57 F3 O P2 Pd -","- C46 H57 F3 O P2 Pd -","- C184 H228 F12 O4 P8 Pd4 -","4","1","","Bakhmutov, Vladimir I.; Bozoglian, Fernando; Gómez, Kerman; González, Gabriel; Grushin, Vladimir V.; Macgregor, Stuart A.; Martin, Eddy; Miloserdov, Fedor M.; Novikov, Maxim A.; Panetier, Julien A.; Romashov, Leonid V.","CF3‒Ph Reductive Elimination from [(Xantphos)Pd(CF3)(Ph)]","Organometallics","2012","31","4","1315","","10.1021/om200985g","","","0.71073","MoKα","","0.023","0.0221","","","0.0564","0.0569","","","","","","1.047","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067997","39.77","0.003","9.2842","0.0004","18.4678","0.0011","90","","92.68","0.006","90","","6811.5","0.7","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H46 Cl2 F3 O2 P Pd -","- C32 H46 Cl2 F3 O2 P Pd -","- C256 H368 Cl16 F24 O16 P8 Pd8 -","8","1","","Allgeier, Alan M.; Shaw, Bradley J.; Hwang, Tsang-Lin; Milne, Jacqueline E.; Tedrow, Jason S.; Wilde, Christopher N.","Characterization of Two Stable Degradants of PalladiumtBuXPhos Catalyst and a Unique Dearomatization Reaction","Organometallics","2012","31","2","519","","10.1021/om200988f","","x-ray","1.54178","CuKα","","0.1376","0.1061","","","0.2446","0.2637","","","","","","0.934","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067998","8.049","0.002","16.945","0.005","25.181","0.007","79.179","0.004","82.501","0.004","89.99","0.004","3343.5","1.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H46 F3 N O2 P Pd -","- C33 H46 F3 N O2 P Pd -","- C132 H184 F12 N4 O8 P4 Pd4 -","4","2","","Allgeier, Alan M.; Shaw, Bradley J.; Hwang, Tsang-Lin; Milne, Jacqueline E.; Tedrow, Jason S.; Wilde, Christopher N.","Characterization of Two Stable Degradants of PalladiumtBuXPhos Catalyst and a Unique Dearomatization Reaction","Organometallics","2012","31","2","519","","10.1021/om200988f","","x-ray","0.71073","MoKα","","0.1218","0.083","","","0.2015","0.2247","","","","","","1.077","","","","has coordinates","178570","2020-10-21","18:00:00",""
"4067999","20.1931","0.0013","12.4763","0.0009","15.8809","0.0011","90","","90.649","0.001","90","","4000.7","0.5","218","2","218","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H22 Cu4 F20 N2 -","- C39 H10 Cu4 F20 N2 -","- C156 H40 Cu16 F80 N8 -","4","0.5","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","0.71073","MoKα","","0.041","0.0324","","","0.0938","0.0991","","","","","","1.048","","","","has coordinates,has disorder","178570","2020-10-21","18:00:00",""
"4068000","6.1085","0.0001","7.5034","0.0002","25.0325","0.0005","90","","95.583","0.001","90","","1141.91","0.04","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H7 Cu F5 N -","- C12 H7 Cu F5 N -","- C48 H28 Cu4 F20 N4 -","4","1","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","1.54178","CuKα","","0.0263","0.026","","","0.0696","0.0699","","","","","","1.186","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068001","12.5523","0.0002","7.1538","0.0002","24.891","0.0005","90","","98.521","0.001","90","","2210.46","0.08","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H4 Cl Cu F5 N -","- C11 H4 Cl Cu F5 N -","- C88 H32 Cl8 Cu8 F40 N8 -","8","2","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","1.54178","CuKα","","0.0365","0.0335","","","0.0882","0.0906","","","","","","1.161","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068002","5.9779","0.0004","7.2228","0.0006","13.4698","0.001","91.634","0.002","90.298","0.002","95.32","0.002","578.83","0.08","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H7 Cu F5 N -","- C12 H7 Cu F5 N -","- C24 H14 Cu2 F10 N2 -","2","1","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","0.71073","MoKα","","0.0464","0.0422","","","0.1168","0.1207","","","","","","1.064","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068003","5.9903","0.0009","7.28","0.001","13.0816","0.0019","88.434","0.002","86.879","0.002","83.596","0.002","565.95","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H4 Cl Cu F5 N -","- C11 H4 Cl Cu F5 N -","- C22 H8 Cl2 Cu2 F10 N2 -","2","1","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","0.71073","MoKα","","0.0296","0.0275","","","0.075","0.0767","","","","","","1.074","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068004","8.7282","0.0009","24.282","0.003","7.034","0.0007","90","","112.065","0.002","90","","1381.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H8 Cu F5 N2 -","- C16 H8 Cu F5 N2 -","- C64 H32 Cu4 F20 N8 -","4","1","","Doshi, Ami; Sundararaman, Anand; Venkatasubbaiah, Krishnan; Zakharov, Lev N.; Rheingold, Arnold L.; Myahkostupov, Mykhaylo; Piotrowiak, Piotr; Jäkle, Frieder","Pentafluorophenyl Copper‒Pyridine Complexes: Synthesis, Supramolecular Structures via Cuprophilic and π-Stacking Interactions, and Solid-State Luminescence","Organometallics","2012","31","4","1546","","10.1021/om200989b","","","0.71073","MoKα","","0.0368","0.0272","","","0.0628","0.0649","","","","","","0.967","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068005","25.203","0.003","26.186","0.002","13.8835","0.0015","90","","90","","90","","9162.6","1.6","146","2","146","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C78 H125 N O17 Pd2 -","- C78 H120 N O17 Pd2 -","- C312 H480 N4 O68 Pd8 -","4","1","","Hashmi, A. Stephen K.; Grundl, Marc A.; Riedel, Dominic; Rudolph, Matthias; Bats, Jan W.","A Highly Diastereoselective Recognition Process as the Basis for the Resolution of Palladatricyclo[4.1.0.02,4]heptanes","Organometallics","2012","31","2","523","","10.1021/om2009952","","","0.71073","MoKα","","0.0659","0.0421","","","0.0786","0.0843","","","","","","1.079","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068006","7.1069","0.0003","10.2591","0.0005","14.0287","0.0006","82.28","0.004","77.127","0.004","89.703","0.004","987.77","0.08","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 N O5 Pd -","- C20 H21 N O5 Pd -","- C40 H42 N2 O10 Pd2 -","2","1","","Grande, Loreto; Serrano, Elena; Cuesta, Luciano; Urriolabeitia, Esteban P.","Regioselective CH Bond Activation on Stabilized Nitrogen Ylides Promoted by Pd(II) Complexes: Scope and Limitations","Organometallics","2012","31","1","394","","10.1021/om201001c","","","0.71073","MoKα","","0.0321","0.0245","","","0.055","0.0563","","","","","","0.994","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068007","13.266","0.005","13.365","0.005","20.934","0.008","90","","102.354","0.012","90","","3626","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H37 F6 N5 O4 Pd -","- C35 H37 F6 N5 O4 Pd -","- C140 H148 F24 N20 O16 Pd4 -","4","1","","Yuan, Dan; Huynh, Han Vinh","1,2,3-Triazolin-5-ylidenes: Synthesis of Hetero-bis(carbene) Pd(II) Complexes, Determination of Donor Strengths, and Catalysis","Organometallics","2012","31","1","405","","10.1021/om2010029","","","0.71073","MoKα","","0.0842","0.0612","","","0.1384","0.1482","","","","","","1.064","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068008","15.14","0.002","15.14","0.002","9.62","0.0019","90","","90","","90","","2205.1","0.6","193","2","193","2","","","","","","","","8","P 42 b c","P 4c -2ab","106","","","","- C21 H19 B2 Co F8 Fe N O -","- C21 H19 B2 Co F8 Fe N O -","- C84 H76 B8 Co4 F32 Fe4 N4 O4 -","4","0.5","","Huesmann, Hannah; Förster, Christoph; Siebler, Daniel; Gasi, Teuta; Heinze, Katja","Amide-Linked Heterobi- and Heterotermetallocenes with Very Low HOMO‒LUMO Gaps","Organometallics","2012","31","1","413","","10.1021/om201007g","","","0.71073","MoKα","","0.0839","0.0397","","","0.1021","0.1285","","","","","","1.007","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068009","22.8143","0.0017","14.3274","0.001","9.4404","0.0007","90","","99.056","0.002","90","","3047.3","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 Fe N2 O S -","- C34 H38 Fe N2 O S -","- C136 H152 Fe4 N8 O4 S4 -","4","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0801","0.0624","","","0.171","0.1898","","","","","","1.153","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068010","23.433","0.003","15.0754","0.0019","9.029","0.0011","90","","98.591","0.002","90","","3153.8","0.7","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C33 H39 Fe N2 P S -","- C33 H39 Fe N2 P S -","- C132 H156 Fe4 N8 P4 S4 -","4","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0678","0.0503","","","0.1138","0.1215","","","","","","0.969","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068011","10.1974","0.0006","19.5763","0.0011","18.7992","0.001","90","","93.037","0.001","90","","3747.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 Fe N4 S -","- C41 H50 Fe N4 S -","- C164 H200 Fe4 N16 S4 -","4","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0618","0.0409","","","0.0992","0.1053","","","","","","0.929","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068012","10.8768","0.0011","12.2257","0.0013","19.093","0.002","82.156","0.002","73.616","0.002","74.264","0.002","2339.6","0.4","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C57 H57 Fe N5 S -","- C57 H57 Fe N5 S -","- C114 H114 Fe2 N10 S2 -","2","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0581","0.0442","","","0.1276","0.1398","","","","","","1.037","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068013","10.7558","0.0014","16.702","0.002","21.381","0.003","90","","102.326","0.002","90","","3752.4","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 Fe N4 S -","- C42 H42 Fe N4 S -","- C168 H168 Fe4 N16 S4 -","4","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0544","0.0387","","","0.1071","0.1221","","","","","","1.082","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068014","10.0811","0.0008","14.9136","0.0012","21.555","0.002","104.43","0.002","97.897","0.002","109.422","0.001","2872.5","0.4","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C67 H77 Fe N4 O S2 -","- C67 H70 Fe N4 O S2 -","- C134 H140 Fe2 N8 O2 S4 -","2","1","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0823","0.0616","","","0.1797","0.2119","","","","","","1.029","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068015","9.9455","0.0012","11.2972","0.0014","12.5726","0.0016","93.862","0.002","101.938","0.002","114.463","0.002","1239.3","0.3","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H62 Fe N4 S2 -","- C60 H62 Fe N4 S2 -","- C60 H62 Fe N4 S2 -","1","0.5","","Xiao, Jie; Deng, Liang","Synthesis, Structure, and Reactivity Study of Iron(II) Complexes with Bulky Bis(anilido)thioether Ligation","Organometallics","2012","31","1","428","","10.1021/om201010a","","","0.71073","MoKα","","0.0549","0.0446","","","0.1323","0.146","","","","","","0.999","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068016","18.609","0.004","12.831","0.003","17.548","0.004","90","","102.841","0.003","90","","4085.2","1.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H66 N2 Th -","- C44 H66 N2 Th -","- C176 H264 N8 Th4 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71073","MoKα","","0.069","0.046","","","0.1021","0.1117","","","","","","1.008","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068017","10.1705","0.0018","17.003","0.002","19.449","0.003","90","","90","","90","","3363.3","0.9","113","2","113","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H58 F2 Th -","- C34 H58 F2 Th -","- C136 H232 F8 Th4 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71075","MoKα","","0.071","0.0687","","","0.1626","0.1649","","","","","","1.041","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068018","10.6319","0.0011","20.767","0.002","32.426","0.003","90","","98.698","0.001","90","","7077.1","1.2","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 Br2 Th -","- C34 H58 Br2 Th -","- C272 H464 Br16 Th8 -","8","2","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71075","MoKα","","0.0472","0.039","","","0.0825","0.0859","","","","","","1.063","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068019","10.729","0.0007","23.149","0.0014","21.7431","0.0011","90","","112.644","0.002","90","","4984","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C59 H79 N Th -","- C59 H79 N Th -","- C236 H316 N4 Th4 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71073","MoKα","","0.0421","0.0304","","","0.0595","0.0631","","","","","","0.998","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068020","10.2478","0.0019","19.685","0.004","20.358","0.004","90","","114.909","0.008","90","","3724.8","1.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H67 N Si Th -","- C37 H67 N Si Th -","- C148 H268 N4 Si4 Th4 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71073","MoKα","","0.0496","0.0331","","","0.0624","0.0679","","","","","","0.981","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068021","10.456","0.001","30.093","0.004","17.748","0.002","90","","123.453","0.005","90","","4659.3","1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H60 N2 O Se3 Th -","- C49 H60 N2 O Se3 Th -","- C196 H240 N8 O4 Se12 Th4 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71073","MoKα","","0.0672","0.0427","","","0.0749","0.0835","","","","","","0.965","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068022","21.603","0.003","9.0336","0.0014","15.862","0.002","90","","105.185","0.003","90","","2987.4","0.7","150","2","150","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 -","- C34 H58 -","- C136 H232 -","4","1","","Ren, Wenshan; Zi, Guofu; Walter, Marc D.","Synthesis, Structure, and Reactivity of a Thorium Metallocene Containing a 2,2′-Bipyridyl Ligand","Organometallics","2012","31","2","672","","10.1021/om201015f","","","0.71073","MoKα","","0.0812","0.0504","","","0.1144","0.1293","","","","","","1.036","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068023","20.377","0.0019","17.9161","0.0017","33.864","0.003","90","","90","","90","","12363","2","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C67 H58 B Cu O P4 -","- C67 H58 B Cu O P4 -","- C536 H464 B8 Cu8 O8 P32 -","8","1","","Ángeles Fuentes, M.; Álvarez, Eleuterio; Caballero, Ana; Pérez, Pedro J.","[(PhBP3)Cu(PPh3)] as a Surrogate of TpxCuL in Homogeneous Catalysis (PhBP3= PhB(CH2PPh2)3; Tpx= Hydrotrispyrazolylborate)","Organometallics","2012","31","3","959","","10.1021/om201016b","","","0.71073","MoKα","","0.0938","0.062","","","0.1453","0.1921","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4068024","12.6963","0.001","20.8476","0.0016","9.6062","0.0008","90","","106.664","0.001","90","","2435.9","0.3","185","2","185","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 N2 Ni O -","- C27 H32 N2 Ni O -","- C108 H128 N8 Ni4 O4 -","4","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0656","0.0425","","","0.101","0.1118","","","","","","1.009","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068025","9.7228","0.0006","12.8586","0.0007","13.0135","0.0008","60.709","0.001","85.788","0.001","69.607","0.001","1320.62","0.14","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H34 N2 Ni O -","- C31 H34 N2 Ni O -","- C62 H68 N4 Ni2 O2 -","2","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0408","0.0342","","","0.0884","0.0925","","","","","","1.032","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068026","10.887","0.0006","13.3072","0.0008","13.5337","0.0008","70.683","0.001","74.156","0.001","71.136","0.001","1720.4","0.17","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H36 N2 Ni O -","- C35 H36 N2 Ni O -","- C70 H72 N4 Ni2 O2 -","2","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0379","0.0337","","","0.0882","0.0906","","","","","","1.068","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068027","20.7171","0.0017","14.5516","0.0012","17.51","0.0015","90","","97.569","0.001","90","","5232.7","0.8","185","2","185","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 N2 Ni O2 -","- C28 H34 N2 Ni O2 -","- C224 H272 N16 Ni8 O16 -","8","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0535","0.0405","","","0.1033","0.1105","","","","","","1.034","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4068028","20.8591","0.0017","15.3042","0.0012","34.431","0.003","90","","102.402","0.002","90","","10735","1.5","185","2","185","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H31 F3 N2 Ni O -","- C28 H31 F3 N2 Ni O -","- C448 H496 F48 N32 Ni16 O16 -","16","2","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.1246","0.0723","","","0.1648","0.1937","","","","","","1.015","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068029","10.4168","0.0007","24.7978","0.0018","14.408","0.001","90","","96.62","0.001","90","","3697","0.4","185","2","185","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H48 N Ni O P -","- C43 H48 N Ni O P -","- C172 H192 N4 Ni4 O4 P4 -","4","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0907","0.0491","","","0.0925","0.1054","","","","","","0.968","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068030","13.5194","0.0005","11.3647","0.0004","25.5163","0.0009","90","","89.924","0.001","90","","3920.4","0.2","185","2","185","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H46 N Ni O P -","- C49 H46 N Ni O P -","- C196 H184 N4 Ni4 O4 P4 -","4","1","","Song, Dong-Po; Shi, Xin-Cui; Wang, Yong-Xia; Yang, Ji-Xing; Li, Yue-Sheng","Ligand Steric and Electronic Effects on β-Ketiminato Neutral Nickel(II) Olefin Polymerization Catalysts","Organometallics","2012","31","3","966","","10.1021/om2010194","","","0.71073","MoKα","","0.0386","0.0321","","","0.0837","0.0873","","","","","","1.035","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068031","11.6683","0.0003","22.316","0.0003","17.185","0.0003","90","","105.618","0.0007","90","","4309.58","0.15","150.2","","150.2","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C46 H39 Cl2 F3 I N O P2 Pd -","- C46 H39 Cl2 F3 I N O P2 Pd -","- C184 H156 Cl8 F12 I4 N4 O4 P8 Pd4 -","4","1","","Amii, Hideki; Kageyama, Katsuhiko; Kishikawa, Yosuke; Hosokawa, Tsuyoshi; Morioka, Ryo; Katagiri, Toshimasa; Uneyama, Kenji","Preparation, Structure, and Reactions of Trifluoroacetimidoyl Palladium(II) Complexes","Organometallics","2012","31","4","1281","","10.1021/om201021b","","","0.7107","MoKα","","","0.0981","","","0.0125","","","","","1.133","1.133","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068032","18.6641","0.0006","14.0538","0.0005","19.4447","0.0005","90","","108.495","0.002","90","","4836.9","0.3","288.2","","288.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C9 H7 F3 I N O Pd -","- C9 H7 F3 I N O Pd -","- C144 H112 F48 I16 N16 O16 Pd16 -","16","2","","Amii, Hideki; Kageyama, Katsuhiko; Kishikawa, Yosuke; Hosokawa, Tsuyoshi; Morioka, Ryo; Katagiri, Toshimasa; Uneyama, Kenji","Preparation, Structure, and Reactions of Trifluoroacetimidoyl Palladium(II) Complexes","Organometallics","2012","31","4","1281","","10.1021/om201021b","","","0.7107","MoKα","","","0.0516","","","0.055","","","","","1.218","1.218","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068033","14.463","0.002","15.9234","0.0015","21.582","0.004","90","","90","","90","","4970.3","1.2","130","2","130","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","[{(dippe)Ni}2(η2-Cα,Cβ- bis-(4-methyl styryl)ketone)]","","- C47 H82 Ni2 O P4 -","- C47 H82 Ni2 O P4 -","- C188 H328 Ni8 O4 P16 -","4","1","","Castellanos-Blanco, Nahury; Flores-Alamo, Marcos; García, Juventino J.","Nickel-Catalyzed Alkylation and Transfer Hydrogenation of α,β-Unsaturated Enones with Methanol","Organometallics","2012","31","2","680","","10.1021/om2010222","","x-ray","0.71073","MoKα","","0.0686","0.0511","","","0.1245","0.1431","","","","","","1.021","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068034","12.2168","0.0004","32.5462","0.001","12.9459","0.0005","90","","100.724","0.004","90","","5057.5","0.3","130","2","130","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","[{(dippe)Ni}2(ηe2-Cα,Cβ-bis-(4-methoxybenzylidene)acetone)]","","- C47 H82 Ni2 O3 P4 -","- C47 H82 Ni2 O3 P4 -","- C188 H328 Ni8 O12 P16 -","4","1","","Castellanos-Blanco, Nahury; Flores-Alamo, Marcos; García, Juventino J.","Nickel-Catalyzed Alkylation and Transfer Hydrogenation of α,β-Unsaturated Enones with Methanol","Organometallics","2012","31","2","680","","10.1021/om2010222","","x-ray","0.71073","MoKα","","0.0954","0.0688","","","0.1592","0.1687","","","","","","1.054","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068035","15.4669","0.0004","9.5163","0.0003","20.2315","0.0012","90","","90","","90","","2977.8","0.2","130","2","130","2","","","","","","","synthesis as described","5","P c a 21","P 2c -2ac","29","","[(dippe)Ni(η2-Cα,Cβ-dibenzylideneacetone)]","","- C31 H46 Ni O P2 -","- C31 H46 Ni O P2 -","- C124 H184 Ni4 O4 P8 -","4","1","","Castellanos-Blanco, Nahury; Flores-Alamo, Marcos; García, Juventino J.","Nickel-Catalyzed Alkylation and Transfer Hydrogenation of α,β-Unsaturated Enones with Methanol","Organometallics","2012","31","2","680","","10.1021/om2010222","","x-ray","0.71073","MoKα","","0.0338","0.0279","","","0.0592","0.0602","","","","","","0.974","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068036","8.1474","0.0002","8.7859","0.0002","22.8434","0.0008","81.053","0.003","85.32","0.002","83.291","0.002","1600.87","0.08","126","2","126","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","[(dippe)Ni(η2-Cα,Cβ- bis-(4-methyl styryl)ketone)]","","- C33 H50 Ni O P2 -","- C33 H50 Ni O P2 -","- C66 H100 Ni2 O2 P4 -","2","1","","Castellanos-Blanco, Nahury; Flores-Alamo, Marcos; García, Juventino J.","Nickel-Catalyzed Alkylation and Transfer Hydrogenation of α,β-Unsaturated Enones with Methanol","Organometallics","2012","31","2","680","","10.1021/om2010222","","x-ray","0.71073","MoKα","","0.0485","0.0342","","","0.0844","0.0881","","","","","","1.015","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068037","8.351","0.0004","8.7651","0.0005","22.6641","0.0012","79.568","0.004","84.781","0.004","85.861","0.004","1622.14","0.15","125","2","125","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","[(dippe)Ni(η2-Cα,Cβ-bis-(4-methoxybenzylidene)acetone)]","","- C33 H50 Ni O3 P2 -","- C33 H50 Ni O3 P2 -","- C66 H100 Ni2 O6 P4 -","2","1","","Castellanos-Blanco, Nahury; Flores-Alamo, Marcos; García, Juventino J.","Nickel-Catalyzed Alkylation and Transfer Hydrogenation of α,β-Unsaturated Enones with Methanol","Organometallics","2012","31","2","680","","10.1021/om2010222","","x-ray","0.71073","MoKα","","0.0468","0.0338","","","0.0803","0.0825","","","","","","0.981","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068038","11.853","0.002","12.584","0.003","12.958","0.003","70.2","0.04","66","0.03","65.59","0.03","1573.7","0.8","290","2","290","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H24 B22 Br22 Cs2 Hg O4 -","- C14 H24 B22 Br22 Cs2 Hg O4 -","- C14 H24 B22 Br22 Cs2 Hg O4 -","1","0.5","","Himmelspach, Alexander; Sprenger, Jan A. P.; Warneke, Jonas; Zähres, Manfred; Finze, Maik","Mercury(II) Complexes of the Carba-closo-dodecaboranyl Ligands [closo-1-CB11X11]2‒(X = H, F, Cl, Br, I)","Organometallics","2012","31","4","1566","","10.1021/om201023h","","","0.71073","MoKα","","0.0754","0.0435","","","0.0981","0.1192","","","","","","1.045","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068039","9.1445","0.0018","9.4393","0.0019","14.881","0.003","79.62","0.03","73.49","0.03","66.73","0.03","1128","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C4 H3 B22 Cl22 Cs2 Hg N -","- C4 H3 B22 Cl22 Cs2 Hg N -","- C4 H3 B22 Cl22 Cs2 Hg N -","1","0.5","","Himmelspach, Alexander; Sprenger, Jan A. P.; Warneke, Jonas; Zähres, Manfred; Finze, Maik","Mercury(II) Complexes of the Carba-closo-dodecaboranyl Ligands [closo-1-CB11X11]2‒(X = H, F, Cl, Br, I)","Organometallics","2012","31","4","1566","","10.1021/om201023h","","","0.71073","MoKα","","0.0498","0.0423","","","0.113","0.1278","","","","","","1.127","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068040","13.1322","0.0008","11.419","0.0005","11.7541","0.0006","90","","115.264","0.007","90","","1594.01","0.17","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H42 B22 Cs2 Hg O2 -","- C10 H42 B22 Cs2 Hg O2 -","- C20 H84 B44 Cs4 Hg2 O4 -","2","0.5","","Himmelspach, Alexander; Sprenger, Jan A. P.; Warneke, Jonas; Zähres, Manfred; Finze, Maik","Mercury(II) Complexes of the Carba-closo-dodecaboranyl Ligands [closo-1-CB11X11]2‒(X = H, F, Cl, Br, I)","Organometallics","2012","31","4","1566","","10.1021/om201023h","","","0.71073","MoKα","","0.0228","0.0186","","","0.039","0.0395","","","","","","1.044","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068041","15.261","0.003","9.556","0.0019","20.195","0.004","90","","108.83","0.03","90","","2787.5","1.1","290","2","290","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 B11 Br11 Cs Hg -","- C7 H5 B11 Br11 Cs Hg -","- C28 H20 B44 Br44 Cs4 Hg4 -","4","1","","Himmelspach, Alexander; Sprenger, Jan A. P.; Warneke, Jonas; Zähres, Manfred; Finze, Maik","Mercury(II) Complexes of the Carba-closo-dodecaboranyl Ligands [closo-1-CB11X11]2‒(X = H, F, Cl, Br, I)","Organometallics","2012","31","4","1566","","10.1021/om201023h","","","0.71073","MoKα","","0.1281","0.082","","","0.1792","0.1979","","","","","","1.19","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068042","10.908","0.002","17.524","0.004","13.362","0.003","90","","101.36","0.03","90","","2504.1","1","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H78 B22 Hg2 N2 O -","- C33 H78 B22 Hg2 N2 O -","- C66 H156 B44 Hg4 N4 O2 -","2","1","","Himmelspach, Alexander; Sprenger, Jan A. P.; Warneke, Jonas; Zähres, Manfred; Finze, Maik","Mercury(II) Complexes of the Carba-closo-dodecaboranyl Ligands [closo-1-CB11X11]2‒(X = H, F, Cl, Br, I)","Organometallics","2012","31","4","1566","","10.1021/om201023h","","","0.71073","MoKα","","0.0459","0.037","","","0.0952","0.1177","","","","","","1.082","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068043","7.8443","0.0003","9.923","0.0004","12.8246","0.0006","81.119","0.001","81.457","0.001","70.851","0.001","926.57","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H40 Cl2 N4 O2 Pt -","- C44 H40 Cl2 N4 O2 Pt -","- C44 H40 Cl2 N4 O2 Pt -","1","0.5","","Kritchenkov, Andreii S.; Bokach, Nadezhda A.; Kuznetsov, Maxim L.; Dolgushin, Fedor M.; Tung, Tran Q.; Molchanov, Alexander P.; Kukushkin, Vadim Yu.","Facile and Reversible 1,3-Dipolar Cycloaddition of Aryl Ketonitrones to Platinum(II)-Bound Nitriles: Synthetic, Structural, and Theoretical Studies","Organometallics","2012","31","2","687","","10.1021/om201026n","","","0.71073","MoKα","","0.0234","0.0233","","","0.0503","0.0503","","","","","","1.008","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068044","9.998","0.0004","16.8602","0.0006","15.2853","0.0006","90","","95.302","0.001","90","","2565.59","0.17","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H52 Cl8 N6 O2 Pt -","- C50 H52 Cl8 N6 O2 Pt -","- C100 H104 Cl16 N12 O4 Pt2 -","2","0.5","","Kritchenkov, Andreii S.; Bokach, Nadezhda A.; Kuznetsov, Maxim L.; Dolgushin, Fedor M.; Tung, Tran Q.; Molchanov, Alexander P.; Kukushkin, Vadim Yu.","Facile and Reversible 1,3-Dipolar Cycloaddition of Aryl Ketonitrones to Platinum(II)-Bound Nitriles: Synthetic, Structural, and Theoretical Studies","Organometallics","2012","31","2","687","","10.1021/om201026n","","","0.71073","MoKα","","0.0509","0.0273","","","0.0508","0.0587","","","","","","1.029","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068045","8.2527","0.0009","9.1301","0.001","17.0048","0.0018","92.466","0.002","93.487","0.002","97.665","0.002","1265.8","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H29 Br2 N3 O2 Pd S2 -","- C21 H29 Br2 N3 O2 Pd S2 -","- C42 H58 Br4 N6 O4 Pd2 S4 -","2","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0283","0.0254","","","0.0647","0.066","","","","","","1.057","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068046","10.6872","0.0015","11.4989","0.0015","11.8401","0.0016","112.673","0.002","98.655","0.002","98.842","0.002","1291.1","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H27 Cl2 F6 N4 P Pd -","- C22 H27 Cl2 F6 N4 P Pd -","- C44 H54 Cl4 F12 N8 P2 Pd2 -","2","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0291","0.0261","","","0.0652","0.0668","","","","","","1.061","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068047","9.4553","0.001","11.9013","0.0012","14.6164","0.0015","81.319","0.002","81.008","0.002","72.485","0.002","1539.8","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H28 F12 N6 P2 Pd -","- C24 H28 F12 N6 P2 Pd -","- C48 H56 F24 N12 P4 Pd2 -","2","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0263","0.025","","","0.0642","0.065","","","","","","1.059","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068048","13.2126","0.0003","11.4202","0.0003","19.3576","0.0005","90","","99.506","0.002","90","","2880.77","0.13","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H31 F6 N4 P Pd -","- C28 H31 F6 N4 P Pd -","- C112 H124 F24 N16 P4 Pd4 -","4","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0272","0.0231","","","0.056","0.0587","","","","","","1.051","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068049","12.6559","0.0003","14.9426","0.0003","12.3617","0.0003","90","","105.147","0.003","90","","2256.53","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 F6 N4 P Pd -","- C20 H23 F6 N4 P Pd -","- C80 H92 F24 N16 P4 Pd4 -","4","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0306","0.0244","","","0.0568","0.0608","","","","","","1.081","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068050","7.7554","0.0002","9.2465","0.0003","15.3961","0.0005","75.065","0.003","79.798","0.002","88.517","0.002","1049.67","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H22 Br Cl2 N3 Pd -","- C19 H22 Br Cl2 N3 Pd -","- C38 H44 Br2 Cl4 N6 Pd2 -","2","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0378","0.0285","","","0.0543","0.0586","","","","","","1.038","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068051","10.491","0.003","20.997","0.004","11.263","0.003","90","","90.03","0.03","90","","2481","1.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H27 Cl N2 Pd -","- C28.839 H27 Cl1.161 N2 Pd -","- C115.356 H108 Cl4.644 N8 Pd4 -","4","2","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Montini, Tiziano; Fornasiero, Paolo; Zangrando, Ennio; Milani, Barbara; Albrecht, Martin","Palladium Carbene Complexes for Selective Alkene Di- and Oligomerization","Organometallics","2012","31","3","976","","10.1021/om201027y","","","0.71073","MoKα","","0.0656","0.0429","","","0.0901","0.0957","","","","","","0.916","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068052","12.613","0.002","11.307","0.002","21.148","0.002","90","","104.57","0.02","90","","2919","0.8","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H82 Cl2 N8 Si4 -","- C52 H82 Cl2 N8 Si4 -","- C104 H164 Cl4 N16 Si8 -","2","0.5","","Sen, Sakya S.; Hey, Jakob; Kratzert, Daniel; Roesky, Herbert W.; Stalke, Dietmar","A Remarkable End-On Activation of Diazoalkane and Cleavage of Both C‒Cl Bonds of Dichloromethane with a Silylene to a Single Product with Five-Coordinate Silicon Atoms","Organometallics","2012","31","1","435","","10.1021/om201031n","","","0.71073","MoKα","","0.0526","0.0404","","","0.0993","0.1101","","","","","","1.059","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068053","14.8427","0.0007","13.6256","0.0007","17.5591","0.0008","90","","100.029","0.002","90","","3496.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H48 Cl4 N4 Si2 -","- C31 H48 Cl4 N4 Si2 -","- C124 H192 Cl16 N16 Si8 -","4","1","","Sen, Sakya S.; Hey, Jakob; Kratzert, Daniel; Roesky, Herbert W.; Stalke, Dietmar","A Remarkable End-On Activation of Diazoalkane and Cleavage of Both C–Cl Bonds of Dichloromethane with a Silylene to a Single Product with Five-Coordinate Silicon Atoms","Organometallics","2012","31","1","435","","10.1021/om201031n","","","0.71073","MoKα","","0.0288","0.0251","","","0.0655","0.0678","","","","","","1.029","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068054","18.9734","0.0006","9.1982","0.0003","19.561","0.0007","90","","93.692","0.002","90","","3406.7","0.2","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H39 N Ni O2 P2 -","- C38 H39 N Ni O2 P2 -","- C152 H156 N4 Ni4 O8 P8 -","4","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.1853","0.0921","","","0.2045","0.2675","","","","","","1.006","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068055","10.0031","0.0002","16.4058","0.0004","18.7458","0.0005","64.688","0.001","75.422","0.001","90.006","0.001","2670.99","0.11","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H37 N Ni O2 P2 -","- C26 H37 N Ni O2 P2 -","- C104 H148 N4 Ni4 O8 P8 -","4","2","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.1671","0.1348","","","0.3727","0.3947","","","","","","1.141","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068056","9.344","0.0006","30.669","0.0019","43.427","0.0019","90","","90","0.003","90","","12444.9","1.2","200","2","200","2","","","","","","","","6","F 2 d d","F -2d 2","43","","","","- C34 H39 N Ni O1.5 P2 -","- C34 H39 N Ni O1.5 P2 -","- C544 H624 N16 Ni16 O24 P32 -","16","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","mokα","","0.214","0.0956","","","0.1863","0.251","","","","","","1.027","","","","has coordinates","264242","2021-04-16","08:49:44",""
"4068057","12.3301","0.0002","9.8228","0.0002","21.4679","0.0004","90","","96.656","0.001","90","","2582.58","0.08","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H39 N Ni O P2 -","- C26 H39 N Ni O P2 -","- C104 H156 N4 Ni4 O4 P8 -","4","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.0402","0.0318","","","0.0817","0.0865","","","","","","1.081","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068058","9.7027","0.0003","12.0266","0.0004","17.079","0.0007","100.155","0.002","93.943","0.002","94.441","0.002","1948.94","0.12","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H51 N Ni O P2 -","- C43 H51 N Ni O P2 -","- C86 H102 N2 Ni2 O2 P4 -","2","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.1024","0.0637","","","0.1517","0.1908","","","","","","1.128","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068059","10.4401","0.0003","11.1317","0.0003","16.0117","0.0005","92.613","0.001","96.759","0.001","105.773","0.002","1772.43","0.09","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H46 N Ni O P2 -","- C41 H46 N Ni O P2 -","- C82 H92 N2 Ni2 O2 P4 -","2","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.0806","0.0551","","","0.145","0.1708","","","","","","1.087","","","","has coordinates","271679","2022-01-02","08:39:52",""
"4068060","10.804","0.0003","16.496","0.0011","22.579","0.0005","90","","76.16","","90","","3907.3","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H39 N Ni O3 P2 -","- C47 H39 N Ni O3 P2 -","- C188 H156 N4 Ni4 O12 P8 -","4","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.0673","0.0426","","","0.1026","0.1166","","","","","","1.029","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068061","9.6323","0.0001","18.6467","0.0003","22.6508","0.0004","90","","100.805","0.001","90","","3996.2","0.1","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H42 N2 Ni O2 P2 -","- C47 H42 N2 Ni O2 P2 -","- C188 H168 N8 Ni4 O8 P8 -","4","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.0858","0.0599","","","0.1526","0.1718","","","","","","1.073","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068062","9.9589","0.0004","28.2374","0.0015","13.0891","0.0007","90","","110.598","0.002","90","","3445.5","0.3","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C37 H48 N2 Ni O P2 -","- C37 H48 N2 Ni O P2 -","- C148 H192 N8 Ni4 O4 P8 -","4","2","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.2418","0.1134","","","0.1944","0.2566","","","","","","1.024","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068063","14.6381","0.0006","19.0373","0.0008","19.6577","0.0011","90","","90","","90","","5478","0.4","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H35 N Ni P2 -","- C31 H35 N Ni P2 -","- C248 H280 N8 Ni8 P16 -","8","1","","Liang, Lan-Chang; Hung, Yu-Ting; Huang, Yu-Lun; Chien, Pin-Shu; Lee, Pei-Ying; Chen, Wei-Chen","Divergent Carbonylation Reactivity Preferences of Nickel Complexes Containing Amido Pincer Ligands: Migratory Insertion versus Reductive Elimination","Organometallics","2012","31","2","700","","10.1021/om201041z","","","0.71073","MoKα","","0.1298","0.0674","","","0.1604","0.2074","","","","","","1.098","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068064","7.5122","0.0001","18.2898","0.0004","15.6915","0.0003","90","","97.388","0.001","90","","2138.06","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H25 N O5 W -","- C23 H25 N O5 W -","- C92 H100 N4 O20 W4 -","4","1","","Khosla, Chetna; Jackson, Andrew B.; White, Peter S.; Templeton, Joseph L.","Bis(acetylacetonate) Tungsten(IV) Complexes Containing a π-Basic Diazoalkane or Oxo Ligand","Organometallics","2012","31","3","987","","10.1021/om201050j","","","0.71073","MoKα","","0.0395","0.0279","","","0.0516","0.056","","","","","","1.042","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068065","8.3894","0.0008","9.2655","0.0009","27.126","0.003","90","","92.963","0.004","90","","2105.7","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 O5 W -","- C24 H24 O5 W -","- C96 H96 O20 W4 -","4","1","","Khosla, Chetna; Jackson, Andrew B.; White, Peter S.; Templeton, Joseph L.","Bis(acetylacetonate) Tungsten(IV) Complexes Containing a π-Basic Diazoalkane or Oxo Ligand","Organometallics","2012","31","3","987","","10.1021/om201050j","","","0.71073","MoKα","","0.0344","0.0266","","","0.0628","0.0694","","","","","","1.166","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068066","9.995","0.0005","10.7278","0.0005","13.1644","0.0006","96.237","0.003","92.891","0.003","109.044","0.003","1320.84","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H26 Cl2 N2 O5 W -","- C25 H26 Cl2 N2 O5 W -","- C50 H52 Cl4 N4 O10 W2 -","2","1","","Khosla, Chetna; Jackson, Andrew B.; White, Peter S.; Templeton, Joseph L.","Bis(acetylacetonate) Tungsten(IV) Complexes Containing a π-Basic Diazoalkane or Oxo Ligand","Organometallics","2012","31","3","987","","10.1021/om201050j","","","1.54178","CuKα","","0.0254","0.024","","","0.0547","0.0554","","","","","","1.104","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068067","8.1887","0.0003","13.2225","0.0005","16.1876","0.0006","90","","95.298","0.002","90","","1745.23","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 N O5 W -","- C17 H19 N O5 W -","- C68 H76 N4 O20 W4 -","4","1","","Khosla, Chetna; Jackson, Andrew B.; White, Peter S.; Templeton, Joseph L.","Bis(acetylacetonate) Tungsten(IV) Complexes Containing a π-Basic Diazoalkane or Oxo Ligand","Organometallics","2012","31","3","987","","10.1021/om201050j","","","1.54178","CuKα","","0.0525","0.0474","","","0.1231","0.1268","","","","","","1.079","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068068","7.6148","0.0002","7.8191","0.0002","16.5655","0.0004","96.104","0.001","92.709","0.001","100.728","0.001","961.32","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H23 N O5 W -","- C18 H23 N O5 W -","- C36 H46 N2 O10 W2 -","2","1","","Khosla, Chetna; Jackson, Andrew B.; White, Peter S.; Templeton, Joseph L.","Bis(acetylacetonate) Tungsten(IV) Complexes Containing a π-Basic Diazoalkane or Oxo Ligand","Organometallics","2012","31","3","987","","10.1021/om201050j","","","0.71073","MoKα","","0.0178","0.0161","","","0.0365","0.037","","","","","","1.037","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068069","8.5499","0.0005","11.5056","0.0007","11.6973","0.0007","90","","92.589","0.001","90","","1149.51","0.12","140","1","140","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 F3 N3 Ti -","- C11 H10 F3 N3 Ti -","- C44 H40 F12 N12 Ti4 -","4","1","","Taw, Felicia L.; Clark, Aurora E.; Mueller, Alexander H.; Janicke, Michael T.; Cantat, Thibault; Scott, Brian L.; Hay, P. Jeffrey; Hughes, Russell P.; Kiplinger, Jaqueline L.","Titanium(IV) Trifluoromethyl Complexes: New Perspectives on Bonding from Organometallic Fluorocarbon Chemistry","Organometallics","2012","31","4","1484","","10.1021/om201055e","","","0.71073","MoKα","","0.0282","0.0251","","","0.0744","0.0761","","","","","","1.226","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068070","6.929","0.0015","12.277","0.002","13.134","0.003","90","","90","","90","","1117.3","0.4","140","1","140","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 Cl F3 Ti -","- C10.855 H10 Cl1.145 F3 Ti -","- C43.42 H40 Cl4.58 F12 Ti4 -","4","1","","Taw, Felicia L.; Clark, Aurora E.; Mueller, Alexander H.; Janicke, Michael T.; Cantat, Thibault; Scott, Brian L.; Hay, P. Jeffrey; Hughes, Russell P.; Kiplinger, Jaqueline L.","Titanium(IV) Trifluoromethyl Complexes: New Perspectives on Bonding from Organometallic Fluorocarbon Chemistry","Organometallics","2012","31","4","1484","","10.1021/om201055e","","","0.71073","MoKα","","0.0864","0.0612","","","0.1225","0.1299","","","","","","1.229","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068071","27.993","0.004","27.993","0.004","8.8744","0.0012","90","","90","","90","","6954.1","1.7","100","2","100","2","","","","","","","","4","I -4","I -4","82","","","","- C144 H196 Li20 N16 -","- C144 H196 Li20 N16 -","- C288 H392 Li40 N32 -","2","0.25","","Pöppler, Ann-Christin; Meinholz, Margret M.; Faßhuber, Hannes; Lange, Adam; John, Michael; Stalke, Dietmar","Mixed Crystalline Lithium Organics and Interconversion in Solution","Organometallics","2012","31","1","42","","10.1021/om2010639","","","0.71073","MoKα","","0.0457","0.0379","","","0.0912","0.095","","","","","","1.08","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068072","49.128","0.003","5.709","0.0003","36.0273","0.0017","90","","125.257","0.003","90","","8251.2","0.8","298","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H23 Fe N3 O3 -","- C23 H23 Fe N3 O3 -","- C368 H368 Fe16 N48 O48 -","16","2","","Thakur, Arunabha; Ghosh, Sundargopal","An Efficient Ferrocene Derivative as a Chromogenic, Optical, and Electrochemical Receptor for Selective Recognition of Mercury(II) in an Aqueous Environment","Organometallics","2012","31","3","819","","10.1021/om201073g","","","0.71073","MoKα","","0.0705","0.0355","","","0.0474","0.0496","","","","","","0.954","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068073","54.785","0.004","25.759","0.002","38.85","0.005","90","","131.353","0.001","90","","41155","7","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C180 H168 Cl6 F18 Ir6 N18 O19 S6 -","- C178 H166 Cl3 F15 Ir6 N18 O16 S5 -","- C1424 H1328 Cl24 F120 Ir48 N144 O128 S40 -","8","1","","Han, Ying-Feng; Lin, Yue-Jian; Hor, T. S. Andy; Jin, Guo-Xin","Efficient Route to Organometallic Cage Formation via C‒H Activation-Directed Muticomponent Assembly Accompanying Aromatic Guest Encapsulation","Organometallics","2012","31","3","995","","10.1021/om201074k","","","0.71073","MoKα","","0.2039","0.0878","","","0.2105","0.2523","","","","","","0.828","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068074","37.877","0.008","20.798","0.005","30.783","0.012","90","","116.856","0.002","90","","21634","11","203","2","203","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C198 H204 F18 Ir6 N18 O24 S6 -","- C196 H188 F12 Ir6 N18 O18 S4 -","- C784 H752 F48 Ir24 N72 O72 S16 -","4","0.5","","Han, Ying-Feng; Lin, Yue-Jian; Hor, T. S. Andy; Jin, Guo-Xin","Efficient Route to Organometallic Cage Formation via C‒H Activation-Directed Muticomponent Assembly Accompanying Aromatic Guest Encapsulation","Organometallics","2012","31","3","995","","10.1021/om201074k","","","0.71073","MoKα","","0.1313","0.085","","","0.2252","0.2528","","","","","","1.042","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068075","56.022","0.004","25.982","0.002","38.976","0.003","90","","131.891","0.001","90","","42232","6","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C184 H178 F18 Ir6 N18 O18 S6 -","- C182 H178 F12 Ir6 N18 O12 S4 -","- C1456 H1424 F96 Ir48 N144 O96 S32 -","8","1","","Han, Ying-Feng; Lin, Yue-Jian; Hor, T. S. Andy; Jin, Guo-Xin","Efficient Route to Organometallic Cage Formation via C‒H Activation-Directed Muticomponent Assembly Accompanying Aromatic Guest Encapsulation","Organometallics","2012","31","3","995","","10.1021/om201074k","","","0.71073","MoKα","","0.1394","0.0789","","","0.1978","0.229","","","","","","0.874","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068076","17.5094","0.0002","15.9826","0.0002","18.311","0.0002","90","","90","","90","","5124.26","0.1","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H38 F6 Os P2 -","- C23 H38 F6 Os P2 -","- C184 H304 F48 Os8 P16 -","8","1","","Esteruelas, Miguel A.; López, Ana M.; Mozo, Silvia; Oñate, Enrique","Formation of Osmium-Allylphosphinomethanide Complexes by Coupling of an Isopropenyldiisopropylphosphine and Monosubstituted Allenes","Organometallics","2012","31","1","440","","10.1021/om201077b","","","0.7107","MoKα","","0.0786","0.0351","","","0.0781","0.0836","","","","","","0.981","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068077","19.3084","0.0017","16.0356","0.0014","19.7029","0.0017","90","","116.683","0.001","90","","5450.8","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H50 B F24 Os P -","- C55 H50 B F24 Os P -","- C220 H200 B4 F96 Os4 P4 -","4","1","","Esteruelas, Miguel A.; López, Ana M.; Mozo, Silvia; Oñate, Enrique","Formation of Osmium-Allylphosphinomethanide Complexes by Coupling of an Isopropenyldiisopropylphosphine and Monosubstituted Allenes","Organometallics","2012","31","1","440","","10.1021/om201077b","","","0.71073","MoKα","","0.0629","0.0403","","","0.091","0.1021","","","","","","0.977","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068078","9.5868","0.0017","14.893","0.002","12.1232","0.0018","90","","108.183","0.013","90","","1644.5","0.5","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C24 H56 Mg4 O4 -","- C24 H56 Mg4 O4 -","- C48 H112 Mg8 O8 -","2","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.117","0.0559","","","0.115","0.1326","","","","","","0.893","","","","has coordinates,has disorder","178506","2020-10-21","18:00:00",""
"4068079","11.9019","0.0012","16.9005","0.0016","10.99","0.001","90","","103.972","0.007","90","","2145.2","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H62 Cl6 Mg4 O6 -","- C30 H62 Cl6 Mg4 O6 -","- C60 H124 Cl12 Mg8 O12 -","2","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.108","0.0447","","","0.0838","0.0961","","","","","","0.743","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068080","9.635","0.003","11.43","0.005","9.69","0.004","90","","96.2","0.03","90","","1060.9","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H32 Cl2 Li2 O4 -","- C16 H32 Cl2 Li2 O4 -","- C32 H64 Cl4 Li4 O8 -","2","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.2575","0.152","","","0.2743","0.3411","","","","","","1.044","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068081","11.6858","0.0014","13.7053","0.0017","11.2426","0.0014","90","","100.157","0.009","90","","1772.4","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H54 Cl2 Mg2 O2 Si4 -","- C22 H54 Cl2 Mg2 O2 Si4 -","- C44 H108 Cl4 Mg4 O4 Si8 -","2","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.1469","0.053","","","0.0792","0.1013","","","","","","0.724","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068082","13.9678","0.001","7.482","0.0005","12.1077","0.0008","90","","106.633","0.006","90","","1212.4","0.15","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H22 Mg O2 -","- C10 H22 Mg O2 -","- C40 H88 Mg4 O8 -","4","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.0423","0.0393","","","0.1115","0.1135","","","","","","1.072","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068083","19.139","0.002","15.126","0.002","16.9129","0.0016","90","","93.438","0.008","90","","4887.4","0.9","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H70 Cl4 Li2 Mg2 O6 Si4 -","- C30 H70 Cl4 Li2 Mg2 O6 Si4 -","- C120 H280 Cl16 Li8 Mg8 O24 Si16 -","4","0.5","","Blasberg, Florian; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","An Approach to Pin Down the Solid-State Structure of the “Turbo Grignard”","Organometallics","2012","31","3","1001","","10.1021/om201080t","","","0.71073","MoKα","","0.1009","0.0565","","","0.1199","0.1364","","","","","","0.962","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068084","10.1295","0.0003","16.7531","0.0005","14.8948","0.0004","90","","104.342","0.001","90","","2448.88","0.12","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Ir4 O7 -","- C23 H22 Ir4 O7 -","- C92 H88 Ir16 O28 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis of Higher Nuclearity Iridium Clusters: Reaction of [Ir4(CO)11Ph]−with [Ir(COD)Cl]2","Organometallics","2012","31","1","445","","10.1021/om201084h","","","0.71073","MoKα","","0.0316","0.0261","","","0.0743","0.0784","","","","","","1.001","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068085","13.4948","0.0004","13.5381","0.0004","16.3963","0.0005","90","","103.802","0.001","90","","2909.01","0.15","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H17 Ir5 O11 -","- C25 H17 Ir5 O11 -","- C100 H68 Ir20 O44 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis of Higher Nuclearity Iridium Clusters: Reaction of [Ir4(CO)11Ph]−with [Ir(COD)Cl]2","Organometallics","2012","31","1","445","","10.1021/om201084h","","","0.71073","MoKα","","0.0429","0.0359","","","0.0945","0.0991","","","","","","1.058","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068086","15.65","0.0007","12.457","0.0006","18.2221","0.0008","90","","97.822","0.001","90","","3519.4","0.3","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H31 Cl2 Ir5 O9 -","- C32 H31 Cl2 Ir5 O9 -","- C128 H124 Cl8 Ir20 O36 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis of Higher Nuclearity Iridium Clusters: Reaction of [Ir4(CO)11Ph]−with [Ir(COD)Cl]2","Organometallics","2012","31","1","445","","10.1021/om201084h","","","0.71073","MoKα","","0.0442","0.0372","","","0.1027","0.1105","","","","","","1.074","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068087","13.053","0.0005","13.217","0.0005","28.385","0.0011","90","","98.105","0.001","90","","4848.1","0.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H36 Ir9 O15 -","- C46 H36 Ir9 O15 -","- C184 H144 Ir36 O60 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis of Higher Nuclearity Iridium Clusters: Reaction of [Ir4(CO)11Ph]−with [Ir(COD)Cl]2","Organometallics","2012","31","1","445","","10.1021/om201084h","","","0.71073","MoKα","","0.0951","0.0796","","","0.2519","0.2635","","","","","","1.092","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068088","14.0036","0.0005","12.9445","0.0004","17.9786","0.0006","90","","105.476","0.001","90","","3140.81","0.18","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 Ir5 O7 -","- C31 H35 Ir5.104 O7 -","- C124 H140 Ir20.416 O28 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis of Higher Nuclearity Iridium Clusters: Reaction of [Ir4(CO)11Ph]−with [Ir(COD)Cl]2","Organometallics","2012","31","1","445","","10.1021/om201084h","","","0.71073","MoKα","","0.041","0.0369","","","0.1005","0.1047","","","","","","1.078","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068089","9.354","0.005","23.53","0.014","16.46","0.01","90","","91.667","0.002","90","","3621","4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H55 N O2 Ru Si4 -","- C31 H55 N O2 Ru Si4 -","- C124 H220 N4 O8 Ru4 Si16 -","4","1","","Ochiai, Mitsuyoshi; Hashimoto, Hisako; Tobita, Hiromi","Reactions of a Neutral Silylene Ruthenium Complex with Heterocumulenes: C═O Hydrosilylation of Isocyanates vs C═S Bond Cleavage of Isothiocyanate","Organometallics","2012","31","2","527","","10.1021/om2010854","","","0.7107","MoKα","","0.113","0.0783","","","0.2191","0.2391","","","","","","1.118","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068090","11.7791","0.0006","12.1471","0.0005","14.9347","0.0009","86.458","0.002","74.9512","0.0017","63.014","0.004","1835.01","0.18","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H55 N O Ru S Si4 -","- C31 H55 N O Ru S Si4 -","- C62 H110 N2 O2 Ru2 S2 Si8 -","2","1","","Ochiai, Mitsuyoshi; Hashimoto, Hisako; Tobita, Hiromi","Reactions of a Neutral Silylene Ruthenium Complex with Heterocumulenes: C═O Hydrosilylation of Isocyanates vs C═S Bond Cleavage of Isothiocyanate","Organometallics","2012","31","2","527","","10.1021/om2010854","","","0.71069","MoKα","","0.0954","0.0703","","","0.1717","0.1921","","","","","","1.197","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068091","46.4335","0.0019","7.3273","0.0002","23.5143","0.001","90","","110.669","0.003","90","","7485.4","0.5","180","","180","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C27 H39 B N2 -","- C27 H39 B N2 -","- C324 H468 B12 N24 -","12","3","","Banerjee, Dipshikha; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Borane Complexes: Synthesis and Structural Analysis","Organometallics","2012","31","2","709","","10.1021/om201087n","","","0.71073","MoKα","","0.0551","0.0464","","","0.106","0.1098","","","","","","1.057","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068092","20.7759","0.0008","7.1727","0.0003","19.0739","0.0006","90","","106.583","0.004","90","","2724.16","0.19","189.9","","189.9","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C33 H39 B N2 -","- C33 H39 B N2 -","- C132 H156 B4 N8 -","4","1","","Banerjee, Dipshikha; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Borane Complexes: Synthesis and Structural Analysis","Organometallics","2012","31","2","709","","10.1021/om201087n","","","1.5418","CuKα","","0.0681","0.0542","","","0.1336","0.1448","","","","","","1.035","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068093","12.55564","0.00015","14.24537","0.00018","14.6874","0.0002","90","","98.7154","0.0012","90","","2596.65","0.06","180.15","","180.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H39 B N2 O2 -","- C27 H39 B N2 O2 -","- C108 H156 B4 N8 O8 -","4","2","","Banerjee, Dipshikha; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Borane Complexes: Synthesis and Structural Analysis","Organometallics","2012","31","2","709","","10.1021/om201087n","","","1.5418","CuKα","","0.0494","0.044","","","0.1214","0.1264","","","","","","1.031","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068094","7.4531","0.0006","17.8577","0.0005","26.03","0.0015","90","","90","","90","","3464.5","0.4","180.15","","180.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H47 B N2 O2 -","- C39 H47 B N2 O2 -","- C156 H188 B4 N8 O8 -","4","1","","Banerjee, Dipshikha; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Borane Complexes: Synthesis and Structural Analysis","Organometallics","2012","31","2","709","","10.1021/om201087n","","","1.5418","CuKα","","0.0446","0.0398","","","0.1129","0.1183","","","","","","0.91","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068095","10.7905","0.0007","14.551","0.0009","15.098","0.0009","90","","94.09","0.001","90","","2364.5","0.3","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H34 Br2 N Ni O P -","- C20 H34 Br2 N Ni O P -","- C80 H136 Br8 N4 Ni4 O4 P4 -","4","1","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0476","0.0347","","","0.0901","0.0931","","","","","","0.987","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068096","15.7309","0.0013","11.6766","0.0007","14.6596","0.001","90","","90","","90","","2692.7","0.3","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C23 H40 Br2 N Ni O P -","- C23 H40 Br2 N Ni O P -","- C92 H160 Br8 N4 Ni4 O4 P4 -","4","1","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0692","0.0562","","","0.142","0.1503","","","","","","1.144","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068097","11.2189","0.0009","14.3721","0.0012","15.8988","0.0011","90","","95.171","0.002","90","","2553.1","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H38 Br2 N Ni O P -","- C22 H38 Br2 N Ni O P -","- C88 H152 Br8 N4 Ni4 O4 P4 -","4","1","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0755","0.0636","","","0.1607","0.1725","","","","","","1.061","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068098","10.884","0.002","14.625","0.003","17.988","0.004","90","","122.881","0.003","90","","2404.6","0.9","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H34 Cl2 N O P Pd -","- C20 H34 Cl2 N O P Pd -","- C80 H136 Cl8 N4 O4 P4 Pd4 -","4","1","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0266","0.0231","","","0.0615","0.0628","","","","","","1.042","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068099","17.5777","0.0005","10.4053","0.0003","14.3919","0.0004","90","","90","","90","","2632.3","0.13","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C23 H40 Cl2 N O P Pd -","- C23 H40 Cl2 N O P Pd -","- C92 H160 Cl8 N4 O4 P4 Pd4 -","4","1","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0154","0.0145","","","0.0368","0.0373","","","","","","1.045","","","","has coordinates","178506","2020-10-21","18:00:00",""
"4068100","9.8987","0.0014","14.667","0.002","20.625","0.003","69.682","0.004","88.388","0.005","77.26","0.004","2735.1","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H42 Cl2 N O1.5 P Pd -","- C24 H42 Cl2 N O1.5 P Pd -","- C96 H168 Cl8 N4 O6 P4 Pd4 -","4","2","","Ortiz de la Tabla, Laura; Matas, Inmaculada; Palma, Pilar; Álvarez, Eleuterio; Cámpora, Juan","Nickel and Palladium Complexes with New Phosphinito-Imine Ligands and Their Application as Ethylene Oligomerization Catalysts","Organometallics","2012","31","3","1006","","10.1021/om201088y","","","0.71073","MoKα","","0.0319","0.0253","","","0.0673","0.0692","","","","","","1.08","","","","has coordinates,has disorder","303244","2025-11-10","19:34:57",""
"4068101","11.7551","0.0013","18.556","0.002","21.673","0.003","90","","90","","90","","4727.5","1","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H74 N3 O Si2 Yb -","- C46 H66 N3 O Si2 Yb -","- C184 H264 N12 O4 Si8 Yb4 -","4","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.1089","0.0791","","","0.1483","0.1682","","","","","","1.106","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068102","11.7778","0.0008","18.5593","0.0012","21.6903","0.0015","90","","90","","90","","4741.2","0.6","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H74 N3 O Si2 Y -","- C46 H66 N3 O Si2 Y -","- C184 H264 N12 O4 Si8 Y4 -","4","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.0936","0.0732","","","0.1603","0.1713","","","","","","1.079","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068103","11.7938","0.0011","18.5139","0.0018","21.713","0.002","90","","90","","90","","4741","0.8","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H74 Gd N3 O Si2 -","- C46 H66 Gd N3 O Si2 -","- C184 H264 Gd4 N12 O4 Si8 -","4","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.0869","0.0745","","","0.1229","0.1303","","","","","","1.105","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068104","11.7896","0.0012","18.507","0.002","21.74","0.003","90","","90","","90","","4743.5","1","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H74 N3 O Si2 Sm -","- C46 H66 N3 O Si2 Sm -","- C184 H264 N12 O4 Si8 Sm4 -","4","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.0542","0.0484","","","0.1076","0.1118","","","","","","1.084","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068105","11.7324","0.0003","11.7814","0.0002","20.5952","0.0006","75.163","0.003","79.407","0.003","68.293","0.003","2544.08","0.12","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C44.5 H81 N4 Nd Si4 -","- C44.5 H77 N4 Nd Si4 -","- C89 H154 N8 Nd2 Si8 -","2","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.0337","0.0303","","","0.0764","0.0793","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068106","17.156","0.005","18.248","0.005","13.096","0.004","90","","104.166","0.004","90","","3975","2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H59 Cl N3 Si2 Yb -","- C35 H59 Cl N3 Si2 Yb -","- C140 H236 Cl4 N12 Si8 Yb4 -","4","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.1072","0.0767","","","0.0967","0.1046","","","","","","1.164","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068107","12.9937","0.0018","13.2278","0.0019","18.722","0.003","87.865","0.007","84.872","0.006","82.374","0.007","3175.6","0.8","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C67 H95 B N3 O2 Si2 Sm -","- C67 H95 B N3 O2 Si2 Sm -","- C134 H190 B2 N6 O4 Si4 Sm2 -","2","1","","Liu, Peng; Zhang, Yong; Yao, Yingming; Shen, Qi","Synthesis of Dianionic β-Diketiminate Lanthanide Amides L′LnN(SiMe3)2(THF) by Deprotonation of the β-Diketiminate Ligand L (L = {[(2,6-iPr2C6H3)NC(CH3)]2CH}−) and the Transformation with [HNEt3][BPh4] to the Cationic Samarium Amide [LSmN(SiMe3)2][BPh4]","Organometallics","2012","31","3","1017","","10.1021/om2010904","","","0.71075","MoKα","","0.0593","0.0529","","","0.1092","0.1127","","","","","","1.12","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068108","10.9591","0.0005","15.4387","0.0007","23.2626","0.0011","78.053","0.001","84.774","0.001","69.855","0.001","3614.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C30.4 H41.8 B Cl0.8 Ir N6 O9.5 -","- C30.4 H41.8 B Cl0.8 Ir N6 O9.5 -","- C121.6 H167.2 B4 Cl3.2 Ir4 N24 O38 -","4","2","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaquín; Oñate, Enrique; Paneque, Margarita; Poveda, Manuel L.","Decarbonylation of Aliphatic Aldehydes by a TpMe2Ir(III) Metallacyclopentadiene","Organometallics","2012","31","2","716","","10.1021/om201094q","","","0.71073","MoKα","","0.0405","0.0295","","","0.069","0.0743","","","","","","1.014","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4068109","17.128","0.004","12.347","0.002","16.956","0.004","90","","104.979","0.01","90","","3464","1.3","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dibromo-methylbis(triphenylphosphine oxide-O)antimony(III)","","- C37 H33 Br2 O2 P2 Sb -","- C37 H33 Br2 O2 P2 Sb -","- C148 H132 Br8 O8 P8 Sb4 -","4","0.5","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0501","0.04","","","0.0935","0.0988","","","","","","1.051","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068110","20.039","0.003","9.235","0.002","19.831","0.004","90","","117.145","0.01","90","","3265.7","1.1","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dibromo-methylbis(trimethylphosphine oxide-O)antimony(III)","","- C7 H21 Br2 O2 P2 Sb -","- C7 H21 Br2 O2 P2 Sb -","- C56 H168 Br16 O16 P16 Sb8 -","8","2","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0593","0.0492","","","0.1008","0.1041","","","","","","1.198","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068111","17.307","0.003","12.339","0.003","17.099","0.004","90","","104.664","0.015","90","","3532.6","1.4","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dichloro-methylbis(triphenylphosphine oxide-O)antimony(III)","","- C37 H30 Cl2 O2 P2 Sb -","- C37 H30 Cl2 O2 P2 Sb -","- C148 H120 Cl8 O8 P8 Sb4 -","4","0.5","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0544","0.0415","","","0.1029","0.1106","","","","","","1.027","","","","has coordinates","278046","2022-09-21","15:45:40",""
"4068112","5.4428","0.0005","15.996","0.003","7.7092","0.0015","90","","96.317","0.01","90","","667.11","0.19","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dichloromethyl(1,10-phenanthroline-N,N')antimony(III)","","- C13 H11 Cl2 N2 Sb -","- C13 H11 Cl2 N2 Sb -","- C26 H22 Cl4 N4 Sb2 -","2","0.5","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0457","0.0446","","","0.1067","0.1072","","","","","","1.21","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068113","7.7806","0.0015","16.546","0.003","5.5726","0.001","90","","98.455","0.01","90","","709.6","0.2","120","2","120","2","","","","","","","","5","C 1 m 1","C -2y","8","","dibromo-methyl(1,10-phenanthroline-N,N')antimony(III)","","- C13 H11 Br2 N2 Sb -","- C13 H11 Br2 N2 Sb -","- C26 H22 Br4 N4 Sb2 -","2","0.5","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0182","0.018","","","0.0411","0.0414","","","","","","0.916","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068114","5.7015","0.001","16.459","0.003","7.0828","0.001","90","","95.639","0.01","90","","661.44","0.19","120","2","120","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","Dibromo-methyl(2,2'-bipyridyl-N,N')antimony(III)","","- C11 H11 Br2 N2 Sb -","- C11 H11 Br2 N2 Sb -","- C22 H22 Br4 N4 Sb2 -","2","0.5","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.047","0.0428","","","0.1045","0.1068","","","","","","1.101","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068115","13.023","0.002","7.6958","0.0014","16.455","0.003","90","","93.553","0.007","90","","1646","0.5","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","pentacarbonyl(bromo(dimethyl)stibine)manganese(I) trifluoromethanesulfonate","","- C8 H6 Br F3 Mn O8 S Sb -","- C8 H6 Br F3 Mn O8 S Sb -","- C32 H24 Br4 F12 Mn4 O32 S4 Sb4 -","4","1","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0666","0.0608","","","0.1541","0.1584","","","","","","1.128","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068116","14.4226","0.0005","14.6672","0.001","14.5421","0.001","90","","102.658","0.003","90","","3001.5","0.3","120","2","120","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","fac-tricarbonyltris(bromo(dimethyl)stibine)manganese(I) trifluoromethanesulfonate toluene solvate","","- C17 H26 Br3 F3 Mn O6 S Sb3 -","- C17 H26 Br3 F3 Mn O6 S Sb3 -","- C68 H104 Br12 F12 Mn4 O24 S4 Sb12 -","4","1","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0248","0.0225","","","0.0512","0.0525","","","","","","1.073","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068117","16.261","0.005","6.488","0.005","12.287","0.005","90","","107.735","0.005","90","","1234.7","1.1","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","pentacarbonyl(bromo(dimethyl)stibine)chromium(0)","","- C7 H6 Br Cr O5 Sb -","- C7 H6 Br Cr O5 Sb -","- C28 H24 Br4 Cr4 O20 Sb4 -","4","1","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0661","0.065","","","0.1804","0.1815","","","","","","1.268","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068118","6.607","0.0005","17.0844","0.0015","24.302","0.002","105.828","0.004","96.329","0.004","97.999","0.005","2581.6","0.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","pentacarbonyl(bromo(dimethyl)stibine)tungsten","","- C7 H6 Br O5 Sb W -","- C7 H6 Br O5 Sb W -","- C56 H48 Br8 O40 Sb8 W8 -","8","4","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.033","0.0282","","","0.0653","0.0688","","","","","","1.131","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068119","6.5876","0.001","12.473","0.003","31.209","0.006","90","","90","","90","","2564.4","0.9","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","dibromo(methyl)stibine-pentacarbonyltungsten(0)","","- C6 H3 Br2 O5 Sb W -","- C6 H3 Br2 O5 Sb W -","- C48 H24 Br16 O40 Sb8 W8 -","8","1","","Benjamin, Sophie L.; Levason, William; Reid, Gillian; Warr, Robert P.","Halostibines SbMeX2and SbMe2X: Lewis Acids or Lewis Bases?","Organometallics","2012","31","3","1025","","10.1021/om2010996","","","0.71073","MoKα","","0.0358","0.0277","","","0.0562","0.0604","","","","","","1.115","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068120","9.9558","0.0005","16.3802","0.0007","16.7182","0.0008","90","","90","","90","","2726.4","0.2","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H37 Br N3 Rh -","- C29 H37 Br N3 Rh -","- C116 H148 Br4 N12 Rh4 -","4","1","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Silver and Rhodium 1,2,3-Triazol-5-ylidene Mesoionic Carbene Complexes","Organometallics","2012","31","1","456","","10.1021/om201104f","","","0.71073","MoKα","","0.055","0.047","","","0.1269","0.133","","","","","","1.076","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068121","17.7866","0.0009","34.3081","0.0017","13.4527","0.0007","90","","128.05","0.002","90","","6464.5","0.6","180","2","180","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C57 H76 B2 Cl2 F8 N8 Rh2 -","- C57 H76 B2 Cl2 F8 N8 Rh2 -","- C228 H304 B8 Cl8 F32 N32 Rh8 -","4","0.5","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Silver and Rhodium 1,2,3-Triazol-5-ylidene Mesoionic Carbene Complexes","Organometallics","2012","31","1","456","","10.1021/om201104f","","","0.71073","MoKα","","0.0524","0.0436","","","0.1189","0.1276","","","","","","1.052","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068122","17.0605","0.0002","23.2997","0.0003","11.8865","0.0003","90","","117.34","0.001","90","","4197.15","0.13","180","2","180","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C74 H94 Ag4 Br4 Cl6 N12 -","- C74 H88 Ag4 Br4 Cl6 N12 -","- C148 H176 Ag8 Br8 Cl12 N24 -","2","0.25","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Silver and Rhodium 1,2,3-Triazol-5-ylidene Mesoionic Carbene Complexes","Organometallics","2012","31","1","456","","10.1021/om201104f","","","0.71073","MoKα","","0.0863","0.0752","","","0.2311","0.2446","","","","","","1.108","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068123","14.6121","0.0009","10.5242","0.0006","20.7757","0.0012","90","","100.305","0.005","90","","3143.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H39 Cl2 N3 Ru -","- C35 H39 Cl2 N3 Ru -","- C140 H156 Cl8 N12 Ru4 -","4","1","","Żukowska, Karolina; Szadkowska, Anna; Pazio, Aleksandra E.; Woźniak, Krzysztof; Grela, Karol","Thermal Switchability of N-Chelating Hoveyda-type Catalyst Containing a Secondary Amine Ligand","Organometallics","2012","31","1","462","","10.1021/om2011062","","","0.71073","MoKα","","0.1211","0.0487","","","0.0744","0.0914","","","","","","0.977","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068124","10.9036","0.0003","14.6554","0.0004","25.5143","0.0006","90","","90","","90","","4077.1","0.18","173","2","173","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C45 H53 Br Cl2 N O P Pd -","- C45 H52.99 Br Cl2.01 N O P Pd -","- C180 H211.96 Br4 Cl8.04 N4 O4 P4 Pd4 -","4","1","","Alsabeh, Pamela G.; McDonald, Robert; Stradiotto, Mark","Stoichiometric Reactivity Relevant to the Mor-DalPhos/Pd-Catalyzed Cross-Coupling of Ammonia and 1-Bromo-2-(phenylethynyl)benzene","Organometallics","2012","31","3","1049","","10.1021/om201122q","","","0.71073","MoKα","","0.0296","0.0282","","","0.0835","0.0849","","","","","","1.076","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068125","10.7231","0.0008","16.1892","0.0012","26.826","0.002","90","","105.509","0.0009","90","","4487.4","0.6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C49 H61 F3 N O5 P Pd S -","- C49 H61 F3 N O5 P Pd S -","- C196 H244 F12 N4 O20 P4 Pd4 S4 -","4","1","","Alsabeh, Pamela G.; McDonald, Robert; Stradiotto, Mark","Stoichiometric Reactivity Relevant to the Mor-DalPhos/Pd-Catalyzed Cross-Coupling of Ammonia and 1-Bromo-2-(phenylethynyl)benzene","Organometallics","2012","31","3","1049","","10.1021/om201122q","","","0.71073","MoKα","","0.0538","0.0481","","","0.1205","0.1239","","","","","","1.145","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068126","12.7728","0.0012","12.8949","0.0012","13.2","0.0012","65.406","0.002","67.296","0.002","82.18","0.002","1822.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H48 Cl2 O3 Si2 -","- C32 H48 Cl2 O3 Si2 -","- C64 H96 Cl4 O6 Si4 -","2","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.1374","0.0615","","","0.1437","0.1743","","","","","","0.932","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068127","16.7203","0.0014","19.0221","0.0016","24.15","0.002","90","","91.686","0.002","90","","7677.7","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H54 Cl2 O2 Si2 -","- C36 H54 Cl2 O2 Si2 -","- C288 H432 Cl16 O16 Si16 -","8","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.1058","0.0594","","","0.1336","0.152","","","","","","0.934","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068128","11.8773","0.0007","13.8122","0.0009","37.927","0.002","90","","90","","90","","6222","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H38 Cl2 O2 Si2 -","- C30 H38 Cl2 O2 Si2 -","- C240 H304 Cl16 O16 Si16 -","8","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.0745","0.0452","","","0.0972","0.1059","","","","","","0.903","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068129","11.1662","0.0007","11.3006","0.0007","11.7289","0.0007","90.203","0.001","104.296","0.001","105.396","0.001","1378.92","0.15","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H42 O Si2 Zr -","- C27 H42 O Si2 Zr -","- C54 H84 O2 Si4 Zr2 -","2","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.0355","0.028","","","0.0952","0.1248","","","","","","1.169","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068130","12.6446","0.0009","21.666","0.0015","16.8088","0.0012","90","","102.087","0.001","90","","4502.8","0.6","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H62 Cl2 O2 Si2 Zr -","- C46 H62 Cl2 O2 Si2 Zr -","- C184 H248 Cl8 O8 Si8 Zr4 -","4","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.0428","0.0303","","","0.0739","0.0801","","","","","","1.002","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068131","9.1056","0.0009","14.1077","0.0013","15.0556","0.0014","90","","90","","90","","1934","0.3","132","2","132","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H28 Zr -","- C22 H28 Zr -","- C88 H112 Zr4 -","4","1","","Fu, Xiaoping; Yu, Shasha; Fan, Guoqin; Liu, Yuanhong; Li, Yuxue","Highly Efficient Synthesis ofcis-[3]Cumulenic Diols via Zirconocene-Mediated Coupling of 1,3-Butadiynes with Aldehydes","Organometallics","2012","31","2","531","","10.1021/om201125z","","","0.71073","MoKα","","0.0209","0.0195","","","0.0506","0.052","","","","","","1.077","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068132","14.294","0.0008","13.8238","0.0007","35.2329","0.0017","90","","90","","90","","6961.9","0.6","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H25 N O W -","- C19 H25 N O W -","- C304 H400 N16 O16 W16 -","16","2","","Baillie, Rhett A.; Tran, Tommy; Lalonde, Kathryn M.; Tsang, Jenkins Y. K.; Thibault, Michelle E.; Patrick, Brian O.; Legzdins, Peter","Factors Influencing the Outcomes of Intermolecular C‒H Activations of Hydrocarbons Initiated by CpW(NO)(CH2CMe3)(η3-allyl) Complexes (Cp = η5-C5Me5(Cp*), η5-C5Me4H (Cp′))","Organometallics","2012","31","3","1055","","10.1021/om201133r","","","0.71073","MoKα","","0.0287","0.0253","","","0.0499","0.0508","","","","","","1.287","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068133","8.4341","0.0009","8.4965","0.0009","14.4435","0.0015","85.138","0.005","88.498","0.005","61.891","0.004","909.55","0.17","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H27 N O W -","- C20 H27 N O W -","- C40 H54 N2 O2 W2 -","2","1","","Baillie, Rhett A.; Tran, Tommy; Lalonde, Kathryn M.; Tsang, Jenkins Y. K.; Thibault, Michelle E.; Patrick, Brian O.; Legzdins, Peter","Factors Influencing the Outcomes of Intermolecular C‒H Activations of Hydrocarbons Initiated by CpW(NO)(CH2CMe3)(η3-allyl) Complexes (Cp = η5-C5Me5(Cp*), η5-C5Me4H (Cp′))","Organometallics","2012","31","3","1055","","10.1021/om201133r","","","0.71073","MoKα","","0.0397","0.0377","","","0.0872","0.0884","","","","","","1.226","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068134","9.3285","0.0006","15.5488","0.0009","25.2601","0.0016","90","","90","","90","","3663.9","0.4","103","2","103","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H27 N O W -","- C20 H27 N O W -","- C160 H216 N8 O8 W8 -","8","1","","Baillie, Rhett A.; Tran, Tommy; Lalonde, Kathryn M.; Tsang, Jenkins Y. K.; Thibault, Michelle E.; Patrick, Brian O.; Legzdins, Peter","Factors Influencing the Outcomes of Intermolecular C‒H Activations of Hydrocarbons Initiated by CpW(NO)(CH2CMe3)(η3-allyl) Complexes (Cp = η5-C5Me5(Cp*), η5-C5Me4H (Cp′))","Organometallics","2012","31","3","1055","","10.1021/om201133r","","","0.71073","MoKα","","0.0415","0.027","","","0.0589","0.0646","","","","","","1.01","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068135","9.3219","0.0009","22.502","0.003","22.943","0.003","90","","90","","90","","4812.6","1","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27.5 H35 N O W -","- C27.5 H35 N O W -","- C220 H280 N8 O8 W8 -","8","2","","Baillie, Rhett A.; Tran, Tommy; Lalonde, Kathryn M.; Tsang, Jenkins Y. K.; Thibault, Michelle E.; Patrick, Brian O.; Legzdins, Peter","Factors Influencing the Outcomes of Intermolecular C‒H Activations of Hydrocarbons Initiated by CpW(NO)(CH2CMe3)(η3-allyl) Complexes (Cp = η5-C5Me5(Cp*), η5-C5Me4H (Cp′))","Organometallics","2012","31","3","1055","","10.1021/om201133r","","","0.71073","MoKα","","0.0818","0.0528","","","0.114","0.1309","","","","","","1.075","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4068136","15.875","0.0007","10.3935","0.0004","13.9479","0.0006","90","","115.076","0.002","90","","2084.45","0.16","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 N O W -","- C23 H33 N O W -","- C92 H132 N4 O4 W4 -","4","1","","Baillie, Rhett A.; Tran, Tommy; Lalonde, Kathryn M.; Tsang, Jenkins Y. K.; Thibault, Michelle E.; Patrick, Brian O.; Legzdins, Peter","Factors Influencing the Outcomes of Intermolecular C‒H Activations of Hydrocarbons Initiated by CpW(NO)(CH2CMe3)(η3-allyl) Complexes (Cp = η5-C5Me5(Cp*), η5-C5Me4H (Cp′))","Organometallics","2012","31","3","1055","","10.1021/om201133r","","","0.71073","MoKα","","0.0503","0.0326","","","0.0841","0.0889","","","","","","1.026","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068137","11.387","0.004","11.486","0.004","15.199","0.005","97.975","0.005","98.133","0.005","97.338","0.005","1926.7","1.1","103.15","","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H59 I N O3 P Pd -","- C39 H59 I N O3 P Pd -","- C78 H118 I2 N2 O6 P2 Pd2 -","2","1","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)‒OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0685","0.0496","","","0.0928","0.1034","","","","","","1.109","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068138","25.024","0.014","15.573","0.006","18.105","0.008","90","","111.238","0.002","90","","6576","5","103.15","","103","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H114 I2 O2 P4 Pd2 -","- C60 H114 I2 O2 P4 Pd2 -","- C240 H456 I8 O8 P16 Pd8 -","4","0.5","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)‒OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0658","0.0359","","","0.076","0.0944","","","","","","1.106","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068139","9.713","0.003","11.476","0.003","16.032","0.005","108.242","0.004","90.661","0.004","92.202","0.004","1695.4","0.9","103.15","","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H52 I N O2 P2 Pd -","- C31 H52 I N O2 P2 Pd -","- C62 H104 I2 N2 O4 P4 Pd2 -","2","1","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)‒OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0235","0.0208","","","0.0496","0.0507","","","","","","1.055","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068140","11.693","0.005","15.211","0.007","17.182","0.007","101.897","0.006","96.054","0.006","107.89","0.006","2799","2","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H50 O P2 Pd -","- C26 H50 O P2 Pd -","- C104 H200 O4 P8 Pd4 -","4","2","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)‒OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0453","0.0386","","","0.0741","0.0779","","","","","","1.123","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068141","8.958","0.005","10.801","0.006","16.399","0.01","86.83","0.02","84.948","0.02","82.368","0.019","1565","1.6","103.15","","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H110 O7 P4 Pd2 -","- C58 H110 O7 P4 Pd2 -","- C58 H110 O7 P4 Pd2 -","1","0.5","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)–OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0514","0.0407","","","0.088","0.0943","","","","","","1.087","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068142","11.168","0.003","18.425","0.005","20.282","0.006","90","","93.2049","0.001","90","","4167","2","103.15","","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H70 O5 P2 Pd -","- C41 H70 O5 P2 Pd -","- C164 H280 O20 P8 Pd4 -","4","1","","Hayashi, Yumi; Wada, Shinji; Yamashita, Makoto; Nozaki, Kyoko","Syntheses and Thermolysis of Arylpalladium Hydroxide Complexes: Implications for C(sp2)‒OH Bond-Forming Reductive Elimination To Generate Phenol Derivatives","Organometallics","2012","31","3","1073","","10.1021/om201142s","","","0.7107","MoKα","","0.0835","0.0748","","","0.1633","0.1688","","","","","","1.172","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068143","11.1098","0.0006","27.5014","0.0012","13.702","0.0006","90","","90.515","0.005","90","","4186.3","0.3","170","2","170","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C22 H38 Cl2 F12 Fe2 N4 O9 P4 S2 -","- C22 H38 Cl2 F12 Fe2 N4 O9 P4 S2 -","- C88 H152 Cl8 F48 Fe8 N16 O36 P16 S8 -","4","1","","Chouffai, Dounia; Zampella, Giuseppe; Capon, Jean-François; Gioia, Luca De; Goff, Alan Le; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean","Electrochemical and Theoretical Studies of the Impact of the Chelating Ligand on the Reactivity of [Fe2(CO)4(κ2-LL)(μ-pdt)]+Complexes with Different Substrates (LL = IMe-CH2-IMe, dppe; IMe= 1-Methylimidazol-2-ylidene)","Organometallics","2012","31","3","1082","","10.1021/om201143p","","x-ray","0.71073","MoKα","","0.1475","0.0579","","","0.0897","0.1072","","","","","","0.829","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4068144","16.5222","0.0002","11.8439","0.0001","19.3552","0.0002","90","","110.547","0.0006","90","","3546.62","0.07","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H47 B2 N P2 Ru -","- C37 H47 B2 N P2 Ru -","- C148 H188 B8 N4 P8 Ru4 -","4","1","","Addy, David A.; Phillips, Nicholas; Pierce, Glesni A.; Vidovic, Dragoslav; Krämer, Tobias; Mallick, Dibyendu; Jemmis, Eluvathingal D.; Reid, Gill; Aldridge, Simon","(Dimethylamino)borylene and Related Complexes of Electron-Rich Metal Fragments: Generation of Nucleophile-Resistant Cations by Spontaneous Halide Ejection","Organometallics","2012","31","3","1092","","10.1021/om201144e","","","0.71073","MoKα","","0.0587","0.0445","","0.1294","0.1211","0.1293","","","","","","0.9288","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068145","11.0448","0.0002","19.8456","0.0003","18.779","0.0003","90","","90.185","0.0007","90","","4116.16","0.12","150","","150","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C46 H53.5 B2 F0.5 Fe N O P2 -","- C46 H53.5 B2 F0.5 Fe N O P2 -","- C184 H214 B8 F2 Fe4 N4 O4 P8 -","4","1","","Addy, David A.; Phillips, Nicholas; Pierce, Glesni A.; Vidovic, Dragoslav; Krämer, Tobias; Mallick, Dibyendu; Jemmis, Eluvathingal D.; Reid, Gill; Aldridge, Simon","(Dimethylamino)borylene and Related Complexes of Electron-Rich Metal Fragments: Generation of Nucleophile-Resistant Cations by Spontaneous Halide Ejection","Organometallics","2012","31","3","1092","","10.1021/om201144e","","","0.71073","MoKα","","0.0861","0.0468","","0.1213","0.1078","0.1213","","","","","","0.9143","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4068146","12.6791","0.0001","13.827","0.0002","18.7636","0.0002","100.249","0.0005","101.152","0.0005","95.9108","0.0005","3143.59","0.06","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C67 H45.5 B F24.5 Fe O P2 -","- C67 H45.5 B F24.5 Fe O P2 -","- C134 H91 B2 F49 Fe2 O2 P4 -","2","1","","Addy, David A.; Phillips, Nicholas; Pierce, Glesni A.; Vidovic, Dragoslav; Krämer, Tobias; Mallick, Dibyendu; Jemmis, Eluvathingal D.; Reid, Gill; Aldridge, Simon","(Dimethylamino)borylene and Related Complexes of Electron-Rich Metal Fragments: Generation of Nucleophile-Resistant Cations by Spontaneous Halide Ejection","Organometallics","2012","31","3","1092","","10.1021/om201144e","","","0.71073","MoKα","","0.083","0.069","","0.1822","0.1715","0.1822","","","","","","0.9246","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4068147","12.7513","0.0002","18.2904","0.0003","13.3508","0.0002","90","","97.1003","0.0008","90","","3089.88","0.08","150","","150","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 B Cl Fe N O3 -","- C15 H15 B Cl Fe N O3 -","- C120 H120 B8 Cl8 Fe8 N8 O24 -","8","2","","Addy, David A.; Phillips, Nicholas; Pierce, Glesni A.; Vidovic, Dragoslav; Krämer, Tobias; Mallick, Dibyendu; Jemmis, Eluvathingal D.; Reid, Gill; Aldridge, Simon","(Dimethylamino)borylene and Related Complexes of Electron-Rich Metal Fragments: Generation of Nucleophile-Resistant Cations by Spontaneous Halide Ejection","Organometallics","2012","31","3","1092","","10.1021/om201144e","","","0.71073","MoKα","","0.1011","0.0554","","0.1646","0.1429","0.1646","","","","","","0.9574","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068148","8.0797","0.0004","11.4439","0.0006","12.1157","0.0007","74.117","0.002","83.576","0.003","73.42","0.003","1032","0.1","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C44 H50 Cl2 N6 Ni -","- C44 H50 Cl2 N6 Ni -","- C44 H50 Cl2 N6 Ni -","1","0.5","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.0465","0.0364","","","0.0859","0.0916","","","","","","1.051","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068149","10.0404","0.0003","12.691","0.0004","18.7561","0.0005","104.899","0.0017","93.652","0.0017","105.809","0.0017","2199.14","0.12","150","1","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H50 Cu2 I2 N6 -","- C44 H50 Cu2 I2 N6 -","- C88 H100 Cu4 I4 N12 -","2","1","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.0589","0.0409","","","0.0963","0.1071","","","","","","1.03","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068150","12.3204","0.0003","20.4621","0.0007","9.8781","0.0002","90","","100.961","0.002","90","","2444.85","0.12","150","2","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H62 Cu2 I2 N6 -","- C50 H62 Cu2 I2 N6 -","- C100 H124 Cu4 I4 N12 -","2","0.5","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.0555","0.0375","","","0.0896","0.0989","","","","","","1.066","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068151","8.1267","0.0004","11.8871","0.0005","13.7639","0.0006","90","","98.606","0.002","90","","1314.66","0.1","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C22 H25 Br2 N3 Ni -","- C22 H25 Br2 N3 Ni -","- C44 H50 Br4 N6 Ni2 -","2","0.5","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.1011","0.0653","","","0.1881","0.2063","","","","","","1.117","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068152","8.4551","0.0002","16.1489","0.0005","21.189","0.0006","85.895","0.001","78.833","0.002","76.173","0.002","2755.16","0.14","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C51 H64 Br4 Cl2 N6 Ni2 -","- C51 H64 Br4 Cl2 N6 Ni2 -","- C102 H128 Br8 Cl4 N12 Ni4 -","2","1","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.1038","0.0517","","","0.1141","0.1356","","","","","","1.012","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068153","8.0003","0.0017","11.391","0.002","12.304","0.003","75.148","0.004","84.112","0.004","75.031","0.004","1046.2","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H50 Br1.92 I0.08 N6 Ni -","- C44 H50 Br1.92 I0.08 N6 Ni -","- C44 H50 Br1.92 I0.08 N6 Ni -","1","0.5","","Badaj, Anna C.; Lavoie, Gino G.","Synthesis and Structural Characterization of Nickel(II) Complexes with Imino-N-heterocyclic Carbene Heteroditopic Ligands","Organometallics","2012","31","3","1103","","10.1021/om2011485","","","0.71073","MoKα","","0.0594","0.044","","","0.0954","0.1005","","","","","","1.162","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068154","24.2056","0.0018","7.9758","0.0004","27.112","0.002","90","","119.486","0.005","90","","4556.3","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H46 Cl F18 N10 P3 -","- C32 H46 Cl F18 N10 P3 -","- C128 H184 Cl4 F72 N40 P12 -","4","0.5","","Gierz, Verena; Maichle-Mössmer, Cäcilia; Kunz, Doris","1,10-Phenanthroline Analogue Pyridazine-Based N-Heterocyclic Carbene Ligands","Organometallics","2012","31","2","739","","10.1021/om2011547","","","0.71073","MoKα","","0.0752","0.061","","","0.1464","0.1553","","","","","","1.03","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068155","9.0174","0.0002","10.0868","0.0002","8.9113","0.0002","90","","113.527","0.001","90","","743.16","0.03","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 Cl2 N2 -","- C6 H6 Cl2 N2 -","- C24 H24 Cl8 N8 -","4","1","","Gierz, Verena; Maichle-Mössmer, Cäcilia; Kunz, Doris","1,10-Phenanthroline Analogue Pyridazine-Based N-Heterocyclic Carbene Ligands","Organometallics","2012","31","2","739","","10.1021/om2011547","","","0.71073","MoKα","","0.0369","0.0307","","","0.0738","0.0777","","","","","","1.068","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068156","10.5318","0.001","11.2949","0.001","14.6901","0.0013","80.927","0.007","82.4","0.007","78.517","0.007","1681.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 Ag2 F12 N8 P2 -","- C28 H36 Ag2 F12 N8 P2 -","- C56 H72 Ag4 F24 N16 P4 -","2","1","","Gierz, Verena; Maichle-Mössmer, Cäcilia; Kunz, Doris","1,10-Phenanthroline Analogue Pyridazine-Based N-Heterocyclic Carbene Ligands","Organometallics","2012","31","2","739","","10.1021/om2011547","","","0.71073","MoKα","","0.0527","0.039","","","0.0841","0.089","","","","","","1.063","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068157","22.1049","0.0011","21.2338","0.0014","10.07","0.002","90","","90","","90","","4726.6","1","173","2","173","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C22 H30 F6 N4 P Rh -","- C22 H30 F6 N4 P Rh -","- C176 H240 F48 N32 P8 Rh8 -","8","1","","Gierz, Verena; Maichle-Mössmer, Cäcilia; Kunz, Doris","1,10-Phenanthroline Analogue Pyridazine-Based N-Heterocyclic Carbene Ligands","Organometallics","2012","31","2","739","","10.1021/om2011547","","","0.71073","MoKα","","0.1071","0.0815","","","0.1391","0.1476","","","","","","1.222","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068158","8.0303","0.0015","11.343","0.002","14.297","0.003","108.073","0.003","98.709","0.003","90.588","0.003","1221.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cl2 Ir N5 -","- C26 H28 Cl2 Ir N5 -","- C52 H56 Cl4 Ir2 N10 -","2","1","","Burley, Glenn A.; Boutadla, Youcef; Davies, David L.; Singh, Kuldip","Triazoles from N-Alkynylheterocycles and Their Coordination to Iridium","Organometallics","2012","31","3","1112","","10.1021/om201157g","","","0.71073","MoKα","","0.0511","0.0413","","","0.0879","0.0907","","","","","","0.986","","","","has coordinates","198633","2020-10-21","18:00:00",""
"4068159","9.9127","0.001","11.7673","0.0012","17.9264","0.0018","85.11","0.001","82.067","0.001","75.66","0.001","2003.7","0.4","100","","100","","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C15 H16 O8 P2 W -","- C15 H16 O8 P2 W -","- C60 H64 O32 P8 W4 -","4","2","","Arkhypchuk, Anna I.; Santoni, Marie-Pierre; Ott, Sascha","Revisiting the Phospha-Wittig‒Horner Reaction","Organometallics","2012","31","3","1118","","10.1021/om201158k","","","0.71073","MoKα","","0.0734","0.0473","","","0.1048","0.1141","","","","","","0.967","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068160","10.1221","0.0007","25.2357","0.0016","11.117","0.0008","90","","97.856","0.003","90","","2813.1","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H25 B F15 Si2 -","- C26 H25 B F10 Si2 -","- C104 H100 B4 F40 Si8 -","4","1","","Neu, Rebecca C.; Stephan, Douglas W.","Insertion Reactions of Diazomethanes and Electrophilic Boranes","Organometallics","2012","31","1","46","","10.1021/om2011613","","","0.71073","MoKα","","0.0553","0.0393","","","0.1257","0.1393","","","","","","1","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068161","11.0719","0.0006","15.3825","0.0008","27.1192","0.0012","90","","90","","90","","4618.8","0.4","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H10 B F15 Si -","- C22 H10 B F15 Si -","- C176 H80 B8 F120 Si8 -","8","1","","Neu, Rebecca C.; Stephan, Douglas W.","Insertion Reactions of Diazomethanes and Electrophilic Boranes","Organometallics","2012","31","1","46","","10.1021/om2011613","","","0.71073","MoKα","","0.0499","0.0364","","","0.0879","0.0947","","","","","","1.017","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068162","9.7676","0.0015","15.44","0.002","19.306","0.003","90","","98.467","0.006","90","","2879.8","0.7","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 B F15 Si2 -","- C26 H20 B F15 Si2 -","- C104 H80 B4 F60 Si8 -","4","1","","Neu, Rebecca C.; Stephan, Douglas W.","Insertion Reactions of Diazomethanes and Electrophilic Boranes","Organometallics","2012","31","1","46","","10.1021/om2011613","","","0.71073","MoKα","","0.0808","0.042","","","0.0814","0.0934","","","","","","1.01","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068163","8.2719","0.0003","17.887","0.0007","17.4067","0.0007","90","","92.931","0.002","90","","2572.12","0.17","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H15 B Cl F10 N -","- C30 H15 B Cl F10 N -","- C120 H60 B4 Cl4 F40 N4 -","4","1","","Neu, Rebecca C.; Stephan, Douglas W.","Insertion Reactions of Diazomethanes and Electrophilic Boranes","Organometallics","2012","31","1","46","","10.1021/om2011613","","","0.71073","MoKα","","0.0654","0.041","","","0.0982","0.109","","","","","","1.026","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068164","10.7172","0.0006","10.5334","0.0006","11.1932","0.0006","90","","107.629","0.002","90","","1204.24","0.12","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H B F20 -","- C25 H B F20 -","- C50 H2 B2 F40 -","2","1","","Neu, Rebecca C.; Stephan, Douglas W.","Insertion Reactions of Diazomethanes and Electrophilic Boranes","Organometallics","2012","31","1","46","","10.1021/om2011613","","","0.71073","MoKα","","0.0491","0.038","","","0.1133","0.125","","","","","","0.904","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068165","8.904","0.003","15.036","0.005","23.694","0.007","72.537","0.005","82.375","0.005","75.941","0.005","2929.2","1.6","223","","223","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H52 P2 Pd2 -","- C24 H52 P2 Pd2 -","- C96 H208 P8 Pd8 -","4","2","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","0.71075","MoKα","","","0.0609","","","","0.0826","","","","","","1.12","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068166","9.6253","0.0012","21.282","0.003","16.505","0.002","90","","102.982","0.003","90","","3294.6","0.7","223","","223","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H48 N4 Pd2 -","- C30 H48 N4 Pd2 -","- C120 H192 N16 Pd8 -","4","1","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","0.71075","MoKα","","","0.0551","","","","0.0851","","","","","","1.059","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068167","19.25","0.003","12.261","0.0016","24.132","0.003","90","","108.004","0.009","90","","5416.8","1.3","223","","223","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C60 H82 N4 Ni2 -","- C60 H82 N4 Ni2 -","- C240 H328 N16 Ni8 -","4","0.5","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","0.71075","MoKα","","","0.0851","","","","0.176","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068168","14.1732","0.0007","18.3186","0.0007","22.7582","0.0016","90","","106.101","0.008","90","","5677","0.6","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C61 H82 N4 O2 Pd2 -","- C61 H82 N4 O2 Pd2 -","- C244 H328 N16 O8 Pd8 -","4","1","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","1.54187","CuKα","","","0.0514","","","","0.1327","","","","","","1.119","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068169","14.211","0.0005","18.5314","0.0006","22.6888","0.0016","90","","105.576","0.007","90","","5755.7","0.5","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C61 H86 N4 O2 Pd2 -","- C61 H86 N4 O2 Pd2 -","- C244 H344 N16 O8 Pd8 -","4","1","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","1.54187","CuKα","","","0.0657","","","","0.1849","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068170","20.4847","0.0012","12.2424","0.0007","24.6093","0.0014","90","","112.664","0.0014","90","","5695","0.6","223","","223","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H77 Cl N4 Pd2 -","- C57 H72 Cl N4 Pd2 -","- C228 H288 Cl4 N16 Pd8 -","4","1","","Hruszkewycz, Damian P.; Wu, Jianguo; Green, Jennifer C.; Hazari, Nilay; Schmeier, Timothy J.","Mechanistic Studies of the Insertion of CO2into Palladium(I) Bridging Allyl Dimers","Organometallics","2012","31","1","470","","10.1021/om201163k","","","0.71075","MoKα","","","0.0584","","","","0.1153","","","","","","1.033","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068171","12.375","0.004","22.094","0.006","13.627","0.004","90","","97.067","0.008","90","","3697.5","1.9","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H63 Cl2 N3 Pd -","- C37 H63 Cl2 N3 Pd -","- C148 H252 Cl8 N12 Pd4 -","4","2","","Spallek, Markus J.; Riedel, Dominic; Rominger, Frank; Hashmi, A. Stephen K.; Trapp, Oliver","Six-Membered, Chiral NHCs Derived from Camphor: Structure‒Reactivity Relationship in Asymmetric Oxindole Synthesis","Organometallics","2012","31","3","1127","","10.1021/om201166b","","","0.71073","MoKα","","0.1094","0.0707","","","0.1337","0.1493","","","","","","2.02","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068172","7.5914","0.0001","24.8688","0.0005","11.7953","0.0002","90","","105.369","0.001","90","","2147.19","0.06","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H63 Cl4 N3 Pd -","- C42 H63 Cl4 N3 Pd -","- C84 H126 Cl8 N6 Pd2 -","2","1","","Spallek, Markus J.; Riedel, Dominic; Rominger, Frank; Hashmi, A. Stephen K.; Trapp, Oliver","Six-Membered, Chiral NHCs Derived from Camphor: Structure‒Reactivity Relationship in Asymmetric Oxindole Synthesis","Organometallics","2012","31","3","1127","","10.1021/om201166b","","","0.71073","MoKα","","0.0392","0.0332","","","0.088","0.1008","","","","","","1.142","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068173","10.8158","0.0007","17.263","0.0011","22.0491","0.0014","90","","90","","90","","4116.9","0.5","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H61 Cl6 N3 Pd -","- C37 H61 Cl6 N3 Pd -","- C148 H244 Cl24 N12 Pd4 -","4","1","","Spallek, Markus J.; Riedel, Dominic; Rominger, Frank; Hashmi, A. Stephen K.; Trapp, Oliver","Six-Membered, Chiral NHCs Derived from Camphor: Structure‒Reactivity Relationship in Asymmetric Oxindole Synthesis","Organometallics","2012","31","3","1127","","10.1021/om201166b","","","0.71073","MoKα","","0.0733","0.0525","","","0.1308","0.15","","","","","","1.071","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068174","9.599","0.004","19.149","0.009","26.346","0.01","90","","90","","90","","4843","4","100","2","100","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C42 H54 F6 N6 Ni O6 P4 S2 -","- C42 H54 F6 N6 Ni O6 P4 S2 -","- C168 H216 F24 N24 Ni4 O24 P16 S8 -","4","0.5","","Doud, Michael D.; Grice, Kyle A.; Lilio, Alyssia M.; Seu, Candace S.; Kubiak, Clifford P.","Versatile Synthesis of PR2NR′2Ligands for Molecular Electrocatalysts with Pendant Bases in the Second Coordination Sphere","Organometallics","2012","31","3","779","","10.1021/om201168h","","","0.71073","MoKα","","0.0427","0.0316","","","0.0725","0.1","","","","","","1.142","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068175","12.3519","0.0006","11.7474","0.0006","16.7887","0.0009","90","","99.84","0.003","90","","2400.2","0.2","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 F2 I N P Pd -","- C24 H29 F2 I N P Pd -","- C96 H116 F8 I4 N4 P4 Pd4 -","4","1","","Scharf, Adam; Goldberg, Israel; Vigalok, Arkadi","Palladium-Assisted Room-Temperature Nucleophilic Substitution of an Unactivated Aryl Fluoride","Organometallics","2012","31","4","1275","","10.1021/om201175d","","","0.71073","MoKα","","0.1213","0.0613","","","0.1111","0.1324","","","","","","1.011","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068176","16.7924","0.0005","8.6165","0.0002","32.3673","0.001","90","","90","","90","","4683.3","0.2","110","2","110","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C25 H31 F N O P Pd -","- C25 H31 F N O P Pd -","- C200 H248 F8 N8 O8 P8 Pd8 -","8","1","","Scharf, Adam; Goldberg, Israel; Vigalok, Arkadi","Palladium-Assisted Room-Temperature Nucleophilic Substitution of an Unactivated Aryl Fluoride","Organometallics","2012","31","4","1275","","10.1021/om201175d","","","0.71073","MoKα","","0.1172","0.0713","","","0.1067","0.1221","","","","","","1.054","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068177","11.422","0.0002","20.0331","0.0005","22.3063","0.0005","90","","90","","90","","5104.08","0.19","110","2","110","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C25 H32 B F5 N O P Pd -","- C25 H32 B F5 N O P Pd -","- C200 H256 B8 F40 N8 O8 P8 Pd8 -","8","1","","Scharf, Adam; Goldberg, Israel; Vigalok, Arkadi","Palladium-Assisted Room-Temperature Nucleophilic Substitution of an Unactivated Aryl Fluoride","Organometallics","2012","31","4","1275","","10.1021/om201175d","","","0.71073","MoKα","","0.0837","0.0641","","","0.1034","0.1102","","","","","","1.114","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068178","9.0868","0.0004","22.4891","0.001","11.4638","0.0005","90","","93.017","0.001","90","","2339.43","0.18","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H32 Ge Mo O2 Si3 -","- C17 H32 Ge Mo O2 Si3 -","- C68 H128 Ge4 Mo4 O8 Si12 -","4","1","","Filippou, Alexander C.; Stumpf, Kai W.; Chernov, Oleg; Schnakenburg, Gregor","Metal Activation of a Germylenoid, a New Approach to Metal‒Germanium Triple Bonds: Synthesis and Reactions of the Germylidyne Complexes [Cp(CO)2M≡Ge‒C(SiMe3)3] (M = Mo, W)","Organometallics","2012","31","2","748","","10.1021/om201176n","","","0.71073","MoKα","","0.0154","0.0147","","","0.0384","0.0387","","","","","","1.053","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068179","9.0559","0.0003","22.417","0.0009","11.5366","0.0003","90","","92.938","0.002","90","","2338.92","0.14","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H32 Ge O2 Si3 W -","- C17 H32 Ge O2 Si3 W -","- C68 H128 Ge4 O8 Si12 W4 -","4","1","","Filippou, Alexander C.; Stumpf, Kai W.; Chernov, Oleg; Schnakenburg, Gregor","Metal Activation of a Germylenoid, a New Approach to Metal‒Germanium Triple Bonds: Synthesis and Reactions of the Germylidyne Complexes [Cp(CO)2M≡Ge‒C(SiMe3)3] (M = Mo, W)","Organometallics","2012","31","2","748","","10.1021/om201176n","","","0.71073","MoKα","","0.0485","0.0335","","","0.0736","0.0776","","","","","","0.939","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068180","9.4339","0.0003","20.2764","0.0011","15.1795","0.0006","90","","90.68","0.003","90","","2903.4","0.2","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 Ge Mo N2 O2 Si3 -","- C24 H44 Ge Mo N2 O2 Si3 -","- C96 H176 Ge4 Mo4 N8 O8 Si12 -","4","1","","Filippou, Alexander C.; Stumpf, Kai W.; Chernov, Oleg; Schnakenburg, Gregor","Metal Activation of a Germylenoid, a New Approach to Metal‒Germanium Triple Bonds: Synthesis and Reactions of the Germylidyne Complexes [Cp(CO)2M≡Ge‒C(SiMe3)3] (M = Mo, W)","Organometallics","2012","31","2","748","","10.1021/om201176n","","","0.71073","MoKα","","0.0713","0.0442","","","0.0735","0.0791","","","","","","0.964","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068181","9.4099","0.0002","20.2971","0.0006","15.1689","0.0004","90","","90.5347","0.0016","90","","2897.04","0.13","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 Ge N2 O2 Si3 W -","- C24 H44 Ge N2 O2 Si3 W -","- C96 H176 Ge4 N8 O8 Si12 W4 -","4","1","","Filippou, Alexander C.; Stumpf, Kai W.; Chernov, Oleg; Schnakenburg, Gregor","Metal Activation of a Germylenoid, a New Approach to Metal‒Germanium Triple Bonds: Synthesis and Reactions of the Germylidyne Complexes [Cp(CO)2M≡Ge‒C(SiMe3)3] (M = Mo, W)","Organometallics","2012","31","2","748","","10.1021/om201176n","","","0.71073","MoKα","","0.0442","0.0293","","","0.0555","0.0588","","","","","","0.95","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068182","21.7483","0.0006","21.7483","0.0006","21.7483","0.0006","90","","90","","90","","10286.7","0.5","200","2","200","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C51 H66 Cr2 N3 P4 -","- C51 H66 Cr2 N3 P4 -","- C408 H528 Cr16 N24 P32 -","8","0.333333","","Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Murugesu, Muralee; Budzelaar, Peter","Isolation and Characterization of a Class II Mixed-Valence Chromium(I)/(II) Self-Activating Ethylene Trimerization Catalyst","Organometallics","2012","31","1","486","","10.1021/om201181n","","","0.71073","MoKα","","0.069","0.0426","","","0.1121","0.1408","","","","","","1.035","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068183","11.052","0.003","12.721","0.003","19.714","0.005","90","","91.96","0.003","90","","2770","1.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[PhB(3-C2F5Pz)3]CuC2H4","","","- C23 H15 B Cu F15 N6 -","- C23 H15 B Cu F15 N6 -","- C92 H60 B4 Cu4 F60 N24 -","4","1","","Dias, H. V. Rasika; Wu, Jiang","Structurally Similar, Thermally Stable Copper(I), Silver(I), and Gold(I) Ethylene Complexes Supported by a Fluorinated Scorpionate","Organometallics","2012","31","4","1511","","10.1021/om201185v","","","0.71073","MoKα","","0.0611","0.0507","","","0.1338","0.1403","","","","","","1.077","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068184","11.2741","0.0007","12.8593","0.0008","19.3139","0.0011","90","","90.28","0.001","90","","2800","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[PhB(3-C2F5Pz)3]AgC2H4","","","- C23 H15 Ag B F15 N6 -","- C23 H15 Ag B F15 N6 -","- C92 H60 Ag4 B4 F60 N24 -","4","1","","Dias, H. V. Rasika; Wu, Jiang","Structurally Similar, Thermally Stable Copper(I), Silver(I), and Gold(I) Ethylene Complexes Supported by a Fluorinated Scorpionate","Organometallics","2012","31","4","1511","","10.1021/om201185v","","","0.71073","MoKα","","0.0391","0.0368","","","0.0957","0.0985","","","","","","1.05","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068185","13.254","0.001","14.1925","0.0011","14.9711","0.0012","90","","90","","90","","2816.2","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[PhB(3-C2F5Pz)3]AuC2H4","","","- C23 H15 Au B F15 N6 -","- C23 H15 Au B F15 N6 -","- C92 H60 Au4 B4 F60 N24 -","4","1","","Dias, H. V. Rasika; Wu, Jiang","Structurally Similar, Thermally Stable Copper(I), Silver(I), and Gold(I) Ethylene Complexes Supported by a Fluorinated Scorpionate","Organometallics","2012","31","4","1511","","10.1021/om201185v","","","0.71073","MoKα","","0.0479","0.0381","","","0.0863","0.0911","","","","","","1.069","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068186","10.8217","0.0001","13.8134","0.0001","13.9423","0.0001","90","","100.13","","90","","2051.67","0.03","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(CF3-PCP)Ir(?-4-C5H8)","","","- C17 H15 F12 Ir P2 -","- C17 H15 F12 Ir P2 -","- C68 H60 F48 Ir4 P8 -","4","1","","Adams, Jeramie J.; Arulsamy, Navamoney; Roddick, Dean M.","Investigation of IridiumCF3PCP Pincer Catalytic Dehydrogenation and Decarbonylation Chemistry","Organometallics","2012","31","4","1439","","10.1021/om2011886","","","0.71073","MoKα","","0.0273","0.0199","","","0.0414","0.0434","","","","","","1.01","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068187","11.0551","0.0001","16.0954","0.0002","16.1451","0.0002","90","","107.002","0.001","90","","2747.24","0.06","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(CF3-PCP)Ir(MeP(C2F5)2)CO","","","- C18 H10 F22 Ir O P3 -","- C18 H10 F22 Ir O P3 -","- C72 H40 F88 Ir4 O4 P12 -","4","1","","Adams, Jeramie J.; Arulsamy, Navamoney; Roddick, Dean M.","Investigation of IridiumCF3PCP Pincer Catalytic Dehydrogenation and Decarbonylation Chemistry","Organometallics","2012","31","4","1439","","10.1021/om2011886","","","0.71073","MoKα","","0.0334","0.0204","","","0.0427","0.0476","","","","","","1.015","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4068188","14.86","0.0004","21.4031","0.0006","27.0002","0.0008","98.488","0.002","99.207","0.002","104.333","0.002","8054","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[(CF3-PCP)Ir(CO)]2(u-dfepe)","","","- C36 H18 F44 Ir2 O2 P6 -","- C36 H18 F44 Ir2 O2 P6 -","- C216 H108 F264 Ir12 O12 P36 -","6","3","","Adams, Jeramie J.; Arulsamy, Navamoney; Roddick, Dean M.","Investigation of IridiumCF3PCP Pincer Catalytic Dehydrogenation and Decarbonylation Chemistry","Organometallics","2012","31","4","1439","","10.1021/om2011886","","","0.71073","MoKα","","0.0637","0.0371","","","0.0702","0.0802","","","","","","1.037","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068189","9.8316","0.0001","12.0044","0.0001","16.82","0.0002","71.454","0.001","85.192","0.001","69.039","0.001","1756.49","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 F24 Ir2 P4 -","- C24 H20 F24 Ir2 P4 -","- C48 H40 F48 Ir4 P8 -","2","1","","Adams, Jeramie J.; Arulsamy, Navamoney; Roddick, Dean M.","Investigation of IridiumCF3PCP Pincer Catalytic Dehydrogenation and Decarbonylation Chemistry","Organometallics","2012","31","4","1439","","10.1021/om2011886","","","0.71073","MoKα","","0.0402","0.0264","","","0.0494","0.0531","","","","","","1.008","","","","has coordinates","178571","2020-10-21","18:00:00",""
"4068190","20.746","0.002","7.3201","0.0005","15.5711","0.0017","90","","107.125","0.008","90","","2259.8","0.4","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 F8 N2 Se -","- C10 F8 N2 Se -","- C80 F64 N16 Se8 -","8","2","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.0489","0.034","","","0.0813","0.0863","","","","","","1.003","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068191","9.6911","0.0008","17.783","0.002","9.2819","0.0007","90","","98.52","0.006","90","","1582","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 F8 N2 O S Te -","- C12 H6 F8 N2 O S Te -","- C48 H24 F32 N8 O4 S4 Te4 -","4","1","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.0571","0.0419","","","0.1069","0.1124","","","","","","1.026","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068192","10.3275","0.0011","20.7002","0.0015","9.4642","0.001","90","","90.861","0.008","90","","2023","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 F10 N2 S Te -","- C17 H12 F10 N2 S Te -","- C68 H48 F40 N8 S4 Te4 -","4","1","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.039","0.0273","","","0.0656","0.0716","","","","","","1.051","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068193","10.6254","0.0005","20.319","0.0013","9.0145","0.0004","90","","90.586","0.004","90","","1946.11","0.18","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 F8 N4 S Te -","- C15 H12 F8 N4 S Te -","- C60 H48 F32 N16 S4 Te4 -","4","1","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.0211","0.0195","","","0.0485","0.0495","","","","","","1.066","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068195","25.487","0.003","5.9088","0.0004","16.024","0.002","90","","104.562","0.01","90","","2335.7","0.4","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 F8 N2 Te -","- C10 F8 N2 Te -","- C80 F64 N16 Te8 -","8","2","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.0565","0.0361","","","0.0854","0.0968","","","","","","1.041","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068196","9.5859","0.0013","17.9451","0.0017","8.9832","0.0012","90","","96.345","0.011","90","","1535.8","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 F8 N2 O S Se -","- C12 H6 F8 N2 O S Se -","- C48 H24 F32 N8 O4 S4 Se4 -","4","1","","Aboulkacem, Said; Naumann, Dieter; Tyrra, Wieland; Pantenburg, Ingo","4-Tetrafluoropyridyl Silver(I), AgC5F4N, in Redox Transmetalations with Selenium and Tellurium(23)","Organometallics","2012","31","4","1559","","10.1021/om201195j","","","0.71073","MoKα","","0.0472","0.0376","","","0.0897","0.0942","","","","","","1.065","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068197","12.5007","0.0016","14.6611","0.0018","18.491","0.002","76.3985","0.0015","84.0521","0.0016","86.3437","0.0016","3273.4","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H59 B F24 Ir2 O3 P4 -","- C55 H59 B F24 Ir2 O3 P4 -","- C110 H118 B2 F48 Ir4 O6 P8 -","2","1","","Slaney, Michael E.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Tandem C‒F and C‒H Bond Activation in Fluoroolefins Promoted by a Bis(diethylphosphino)methane-Bridged Diiridium Complex: Role of Water in the Activation Processes","Organometallics","2012","31","4","1384","","10.1021/om2011968","","","0.71073","MoKα","","0.0266","0.0229","","","0.056","0.0578","","","","","","1.023","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068198","12.6522","0.0006","14.9899","0.0007","17.6977","0.0008","97.0697","0.0006","97.5218","0.0006","92.0058","0.0006","3297.8","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H57 B F26 Ir2 O3 P4 -","- C55 H57 B F26 Ir2 O3 P4 -","- C110 H114 B2 F52 Ir4 O6 P8 -","2","1","","Slaney, Michael E.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Tandem C‒F and C‒H Bond Activation in Fluoroolefins Promoted by a Bis(diethylphosphino)methane-Bridged Diiridium Complex: Role of Water in the Activation Processes","Organometallics","2012","31","4","1384","","10.1021/om2011968","","","0.71073","MoKα","","0.084","0.0645","","","0.1394","0.1504","","","","","","1.071","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068199","23.3142","0.0004","10.5973","0.0002","33.2471","0.0005","90","","104.011","0.001","90","","7969.9","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C82 H124 N4 O4 Sc2 -","- C82 H124 N4 O4 Sc2 -","- C328 H496 N16 O16 Sc8 -","4","0.5","","LeBlanc, Francis A.; Berkefeld, Andreas; Piers, Warren E.; Parvez, Masood","Reactivity of Scandium β-Diketiminate Alkyl Complexes with Carbon Dioxide","Organometallics","2012","31","3","810","","10.1021/om2012002","","","1.54178","CuKα","","0.0403","0.0377","","","0.1069","0.1149","","","","","","1.077","","","","has coordinates,has disorder","178571","2020-10-21","18:00:00",""
"4068200","12.8196","0.0004","14.8302","0.0007","16.7243","0.0007","70.686","0.002","80.058","0.002","70.062","0.002","2814.4","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H83 N2 O6 Sc Si2 -","- C46 H75 N2 O6 Sc Si2 -","- C92 H150 N4 O12 Sc2 Si4 -","2","1","","LeBlanc, Francis A.; Berkefeld, Andreas; Piers, Warren E.; Parvez, Masood","Reactivity of Scandium β-Diketiminate Alkyl Complexes with Carbon Dioxide","Organometallics","2012","31","3","810","","10.1021/om2012002","","","0.71073","MoKα","","0.1171","0.0769","","","0.1801","0.202","","","","","","1.073","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068201","8.8444","0.0006","21.2018","0.0014","17.7823","0.0012","90","","101.268","0.002","90","","3270.2","0.4","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C25 H46 B F4 O2 P2 Rh S2 -","- C25 H46 B F4 O2 P2 Rh S2 -","- C100 H184 B4 F16 O8 P8 Rh4 S8 -","4","1","","Montag, Michael; Efremenko, Irena; Diskin-Posner, Yael; Ben-David, Yehoshoa; Martin, Jan M. L.; Milstein, David","Exclusive C‒C Oxidative Addition in a Rhodium Thiophosphoryl Pincer Complex and Computational Evidence for an η3-C‒C‒H Agostic Intermediate","Organometallics","2012","31","1","505","","10.1021/om201205y","","","0.71073","MoKα","","0.0563","0.0389","","","0.0892","0.0972","","","","","","1.07","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4068202","15.329","0.003","17.834","0.004","19.773","0.004","90","","90","","90","","5405.5","1.9","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C23 H17 Cl2 F6 N3 Ni -","- C23 H17 Cl2 F6 N3 Ni -","- C184 H136 Cl16 F48 N24 Ni8 -","8","1","","Antonov, Artem A.; Semikolenova, Nina V.; Zakharov, Vladimir A.; Zhang, Wenjuan; Wang, Youhong; Sun, Wen-Hua; Talsi, Evgenii P.; Bryliakov, Konstantin P.","Vinyl Polymerization of Norbornene on Nickel Complexes with Bis(imino)pyridine Ligands Containing Electron-Withdrawing Groups","Organometallics","2012","31","3","1143","","10.1021/om201213v","","","0.71073","MoKα","","0.1011","0.0838","","","0.2099","0.2249","","","","","","1.168","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068203","18.74","0.004","10.387","0.002","26.3","0.005","90","","90","","90","","5119.4","1.8","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","aqua{dichloro[2,6-bis{1-[(2,6-dichlorophenyl)-imino]ethyl}pyridine]}nickel(II) hydrate ?","","- C21 H19 Cl6 N3 Ni O2 -","- C21 H19 Cl6 N3 Ni O2 -","- C168 H152 Cl48 N24 Ni8 O16 -","8","2","","Antonov, Artem A.; Semikolenova, Nina V.; Zakharov, Vladimir A.; Zhang, Wenjuan; Wang, Youhong; Sun, Wen-Hua; Talsi, Evgenii P.; Bryliakov, Konstantin P.","Vinyl Polymerization of Norbornene on Nickel Complexes with Bis(imino)pyridine Ligands Containing Electron-Withdrawing Groups","Organometallics","2012","31","3","1143","","10.1021/om201213v","","","0.71073","MoKα","","0.0691","0.0641","","","0.1414","0.1461","","","","","","1.081","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068204","8.328","0.0017","24.098","0.005","15.765","0.003","90","","103.39","0.03","90","","3077.8","1.1","273","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 Cl2 F8 N3 Ni O3 -","- C23 H21 Cl2 F8 N3 Ni O3 -","- C92 H84 Cl8 F32 N12 Ni4 O12 -","4","1","","Antonov, Artem A.; Semikolenova, Nina V.; Zakharov, Vladimir A.; Zhang, Wenjuan; Wang, Youhong; Sun, Wen-Hua; Talsi, Evgenii P.; Bryliakov, Konstantin P.","Vinyl Polymerization of Norbornene on Nickel Complexes with Bis(imino)pyridine Ligands Containing Electron-Withdrawing Groups","Organometallics","2012","31","3","1143","","10.1021/om201213v","","","0.71073","MoKα","","0.1029","0.0762","","","0.1765","0.1942","","","","","","1.049","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068205","11.008","0.002","15.888","0.003","15.922","0.004","90","","99.287","0.003","90","","2748.2","1","193","","193","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H42 Ir2 N O2 P S -","- C24 H42 Ir2 N O2 P S -","- C96 H168 Ir8 N4 O8 P4 S4 -","4","1","","Kimura, Takashi; Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Trapping of a Doubly Unsaturated Dinuclear Iridium(II) Sulfonylimido Complex with Phosphine and Lewis Acidic Group 11 and 12 Metals","Organometallics","2012","31","3","1204","","10.1021/om201218j","","","0.7107","MoKα","","","0.0253","","","","0.0696","","","","","","1","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068206","14.259","0.005","11.096","0.004","17.234","0.006","90","","93.46","0.006","90","","2721.8","1.7","193","","193","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C21 H33 Cl2 Ir2 N O2 S Zn -","- C21 H33 Cl2 Ir2 N O2 S Zn -","- C84 H132 Cl8 Ir8 N4 O8 S4 Zn4 -","4","1","","Kimura, Takashi; Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Trapping of a Doubly Unsaturated Dinuclear Iridium(II) Sulfonylimido Complex with Phosphine and Lewis Acidic Group 11 and 12 Metals","Organometallics","2012","31","3","1204","","10.1021/om201218j","","","0.7107","MoKα","","","0.0454","","","","0.0894","","","","","","1.003","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068207","14.616","0.002","10.8891","0.0008","19.568","0.003","90","","107.876","0.005","90","","2964","0.7","193","","193","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H70 Ag4 Cl8 Ir4 N2 O4 S2 -","- C44 H70 Ag4 Cl8 Ir4 N2 O4 S2 -","- C88 H140 Ag8 Cl16 Ir8 N4 O8 S4 -","2","0.5","","Kimura, Takashi; Ishiwata, Koji; Kuwata, Shigeki; Ikariya, Takao","Trapping of a Doubly Unsaturated Dinuclear Iridium(II) Sulfonylimido Complex with Phosphine and Lewis Acidic Group 11 and 12 Metals","Organometallics","2012","31","3","1204","","10.1021/om201218j","","","0.7107","MoKα","","","0.0273","","","","0.0677","","","","","","1.089","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068208","50.829","0.008","50.829","0.008","11.144","0.002","90","","90","","120","","24934","7","113","2","113","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C48 H70 Ca N4 O Si2 -","- C48 H70 Ca N4 O Si2 -","- C864 H1260 Ca18 N72 O18 Si36 -","18","1","","Hu, Hongfan; Cui, Chunming","Synthesis of Calcium and Ytterbium Complexes Supported by a Tridentate Imino-Amidinate Ligand and Their Application in the Intermolecular Hydrophosphination of Alkenes and Alkynes","Organometallics","2012","31","3","1208","","10.1021/om201223j","","","0.71073","MoKα","","0.1316","0.105","","","0.2527","0.2716","","","","","","1.147","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068209","54.906","0.0005","54.906","","14.2772","0.0002","90","","90","","120","","37274.6","0.6","123","2","123","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C66 H133 Br P2 Pt Si8 -","- C66 H133 Br P2 Pt Si8 -","- C1188 H2394 Br18 P36 Pt18 Si144 -","18","1","","Agou, Tomohiro; Sasamori, Takahiro; Tokitoh, Norihiro","Synthesis of an Arylbromosilylene‒Platinum Complex by Using a 1,2-Dibromodisilene As a Silylene Source","Organometallics","2012","31","3","1150","","10.1021/om201227p","","","0.71075","MoKα","","0.0569","0.0428","","","0.1216","0.134","","","","","","1.074","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068210","9.719","0.005","13.992","0.005","27.007","0.005","101.256","0.005","90.339","0.005","101.124","0.005","3531","2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H82 Cl2 N4 O P4 Rh2 -","- C58 H82 Cl2 N4 O P4 Rh2 -","- C116 H164 Cl4 N8 O2 P8 Rh4 -","2","1","","Shaw, Bryan K.; Patrick, Brian O.; Fryzuk, Michael D.","Thermal Rearrangement via P‒C Bond Cleavage of a Tridentate Diphosphine‒N-Heterocyclic Carbene Ligand System Coordinated to Rhodium","Organometallics","2012","31","3","783","","10.1021/om201233e","","","0.71069","MoKα","","0.0702","0.0565","","","0.2088","0.2238","","","","","","1.09","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068211","15.0053","0.0007","8.3101","0.0004","20.9494","0.0009","90","","93.044","0.002","90","","2608.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H41 N2 P2 Rh -","- C27 H41 N2 P2 Rh -","- C108 H164 N8 P8 Rh4 -","4","1","","Shaw, Bryan K.; Patrick, Brian O.; Fryzuk, Michael D.","Thermal Rearrangement via P‒C Bond Cleavage of a Tridentate Diphosphine‒N-Heterocyclic Carbene Ligand System Coordinated to Rhodium","Organometallics","2012","31","3","783","","10.1021/om201233e","","","0.71073","MoKα","","0.0442","0.0369","","","0.0884","0.093","","","","","","1.078","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068212","29.629","0.005","8.564","0.005","27.107","0.005","90","0.005","115.799","0.005","90","0.005","6193","4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C65.75 H86 N4 O P4 Rh2 -","- C65.824 H86 N4 O P4 Rh2 -","- C263.296 H344 N16 O4 P16 Rh8 -","4","0.5","","Shaw, Bryan K.; Patrick, Brian O.; Fryzuk, Michael D.","Thermal Rearrangement via P‒C Bond Cleavage of a Tridentate Diphosphine‒N-Heterocyclic Carbene Ligand System Coordinated to Rhodium","Organometallics","2012","31","3","783","","10.1021/om201233e","","","0.71069","MoKα","","0.0822","0.0453","","","0.0954","0.1068","","","","","","1.017","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068213","8.2723","0.0004","8.5713","0.0004","11.9281","0.0006","108.264","0.001","105.717","0.001","98.202","0.001","748.78","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H12 O16 Ru6 -","- C20 H12 O16 Ru6 -","- C20 H12 O16 Ru6 -","1","0.5","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","Bonding and Reactivity in the Electronically Unsaturated Hydrogen-Bridged Dimer [Ru3(CO)8(μ3-CMe)(μ-H)2(μ3-H)]2","Organometallics","2012","31","1","50","","10.1021/om2012375","","","0.71073","MoKα","","0.0216","0.0202","","","0.0502","0.0509","","","","","","1.051","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068214","11.079","0.0012","13.5376","0.0015","13.5784","0.0015","66.593","0.002","89.78","0.003","70.765","0.002","1745.5","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H28 O7 P2 Ru3 -","- C34 H28 O7 P2 Ru3 -","- C68 H56 O14 P4 Ru6 -","2","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","Bonding and Reactivity in the Electronically Unsaturated Hydrogen-Bridged Dimer [Ru3(CO)8(μ3-CMe)(μ-H)2(μ3-H)]2","Organometallics","2012","31","1","50","","10.1021/om2012375","","","0.71073","MoKα","","0.0991","0.0753","","","0.2061","0.223","","","","","","1.031","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068215","12.1576","0.0005","12.4972","0.0005","24.5708","0.001","90","","102.754","0.001","90","","3641.1","0.3","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H29 Cl O7 P2 Ru3 -","- C34.5 H29 Cl O7 P2 Ru3 -","- C138 H116 Cl4 O28 P8 Ru12 -","4","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","Bonding and Reactivity in the Electronically Unsaturated Hydrogen-Bridged Dimer [Ru3(CO)8(μ3-CMe)(μ-H)2(μ3-H)]2","Organometallics","2012","31","1","50","","10.1021/om2012375","","","0.71073","MoKα","","0.0453","0.0401","","","0.1019","0.1068","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068216","6.4564","0.0002","31.0749","0.0013","17.866","0.0007","90","","99.667","0.002","90","","3533.6","0.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H18 Cl2 N4 O6 Re2 -","- C32 H18 Cl2 N4 O6 Re2 -","- C128 H72 Cl8 N16 O24 Re8 -","4","0.5","","Wu, Si-Hai; Abruña, Héctor D.; Zhong, Yu-Wu","Rhenium Complexes of 2,3-Di(2-pyridyl)-5,6-diphenylpyrazine: Synthesis, Characterization, and Reactivity","Organometallics","2012","31","3","1161","","10.1021/om201240c","","","0.71073","MoKα","","0.0438","0.0309","","","0.0682","0.0735","","","","","","0.893","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068217","14.005","0.003","27.949","0.006","15.408","0.003","90","","100.45","0.03","90","","5931","2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C63 H39 Cl F12 N10 P2 Ru2 -","- C63 H39 Cl F12 N10 P2 Ru2 -","- C252 H156 Cl4 F48 N40 P8 Ru8 -","4","1","","Wu, Si-Hai; Abruña, Héctor D.; Zhong, Yu-Wu","Rhenium Complexes of 2,3-Di(2-pyridyl)-5,6-diphenylpyrazine: Synthesis, Characterization, and Reactivity","Organometallics","2012","31","3","1161","","10.1021/om201240c","","","0.71073","MoKα","","0.1394","0.1167","","","0.2332","0.2476","","","","","","1.179","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068218","12.12","0.002","21.592","0.002","20.208","0.001","90","","117.44","0.02","90","","4693.4","1.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2,6-diisopropyl-phenyl)-[(2-isopropyl-phenyl)-[6-(1H-pyrrol-2-yl)- pyridin-2-yl]-methyl]-amine-bis(tethrahydrofurane)bis(dimethylsilyl) amido-Yttrium(III)","","- C46 H72 N4 O2 Si2 Y -","- C46 H72 N4 O2 Si2 Y -","- C184 H288 N16 O8 Si8 Y4 -","4","1","","Li, Gang; Lamberti, Marina; Mazzeo, Mina; Pappalardo, Daniela; Roviello, Giuseppina; Pellecchia, Claudio","Anilidopyridyl-Pyrrolide and Anilidopyridyl-Indolide Group 3 Metal Complexes: Highly Active Initiators for the Ring-Opening Polymerization ofrac-Lactide","Organometallics","2012","31","3","1180","","10.1021/om201251g","","","0.71073","MoKα","","0.1327","0.0641","","","0.1253","0.1514","","","","","","1.018","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068219","11.195","0.0015","13.546","0.0013","13.666","0.0009","70.993","0.008","89.474","0.009","84.36","0.009","1949.4","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","(2,6-diisopropyl-phenyl)-[(2-isopropyl-phenyl)-[6-(1H-pyrrol-2-yl)- pyridin-2-yl]-methyl]-amine-tethrahydrofurane-bis(dimethylsilyl) amido-Scandium(III)","","- C39 H57 N4 O Sc Si2 -","- C39 H57 N4 O Sc Si2 -","- C78 H114 N8 O2 Sc2 Si4 -","2","1","","Li, Gang; Lamberti, Marina; Mazzeo, Mina; Pappalardo, Daniela; Roviello, Giuseppina; Pellecchia, Claudio","Anilidopyridyl-Pyrrolide and Anilidopyridyl-Indolide Group 3 Metal Complexes: Highly Active Initiators for the Ring-Opening Polymerization ofrac-Lactide","Organometallics","2012","31","3","1180","","10.1021/om201251g","","","0.71073","MoKα","","0.1203","0.0625","","","0.1419","0.1628","","","","","","1.094","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068220","9.9023","0.0004","11.0556","0.0004","11.6943","0.0004","117.631","0.002","95.729","0.002","101.957","0.002","1080.91","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Ga N3 O -","- C24 H32 Ga N3 O -","- C48 H64 Ga2 N6 O2 -","2","1","","Hild, Frédéric; Dagorne, Samuel","A Discrete N,O,N-Supported Gallium Amido Complex for the Intermolecular Hydroamination of Terminal Alkynes","Organometallics","2012","31","3","1189","","10.1021/om2012584","","","0.71073","MoKα","","0.0456","0.0354","","","0.1","0.1241","","","","","","1.199","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068221","10.7114","0.0005","12.016","0.0005","12.5614","0.0009","113.354","0.001","107.228","0.001","103.315","0.001","1301.48","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H68 Cl4 Ga2 N6 O2 -","- C58 H68 Cl4 Ga2 N6 O2 -","- C58 H68 Cl4 Ga2 N6 O2 -","1","0.5","","Hild, Frédéric; Dagorne, Samuel","A Discrete N,O,N-Supported Gallium Amido Complex for the Intermolecular Hydroamination of Terminal Alkynes","Organometallics","2012","31","3","1189","","10.1021/om2012584","","","0.71073","MoKα","","0.0579","0.0449","","","0.1283","0.1357","","","","","","1.069","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068222","11.6738","0.001","12.7915","0.0011","14.4424","0.0012","90.105","0.001","95.338","0.001","95.762","0.001","2136.3","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H67 B N2 Si -","- C43 H67 B N2 Si -","- C86 H134 B2 N4 Si2 -","2","1","","Wang, Yuzhong; Abraham, Mariham Y.; Gilliard, Robert J.; Wei, Pingrong; Smith, Jared C.; Robinson, Gregory H.","From Anionic N-Heterocyclic Dicarbenes to Abnormal Carbene–Borane Complexes: A Logical Synthetic Route","Organometallics","2012","31","3","791","","10.1021/om201259d","","","0.71073","MoKα","","0.1052","0.0655","","","0.1786","0.2061","","","","","","1.052","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068223","9.6164","0.0004","15.3033","0.0006","22.2044","0.0009","90","","90","","90","","3267.7","0.2","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H53 B N2 -","- C34 H53 B N2 -","- C136 H212 B4 N8 -","4","1","","Wang, Yuzhong; Abraham, Mariham Y.; Gilliard, Robert J.; Wei, Pingrong; Smith, Jared C.; Robinson, Gregory H.","From Anionic N-Heterocyclic Dicarbenes to Abnormal Carbene–Borane Complexes: A Logical Synthetic Route","Organometallics","2012","31","3","791","","10.1021/om201259d","","","0.71073","MoKα","","0.0598","0.0519","","","0.1466","0.1546","","","","","","1.025","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068224","11.2979","0.0014","15.4458","0.0019","19.384","0.002","79.11","0.002","81.492","0.002","72.09","0.002","3146.1","0.6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H51 B N2 -","- C33 H51 B N2 -","- C132 H204 B4 N8 -","4","2","","Wang, Yuzhong; Abraham, Mariham Y.; Gilliard, Robert J.; Wei, Pingrong; Smith, Jared C.; Robinson, Gregory H.","From Anionic N-Heterocyclic Dicarbenes to Abnormal Carbene–Borane Complexes: A Logical Synthetic Route","Organometallics","2012","31","3","791","","10.1021/om201259d","","","0.71073","MoKα","","0.1201","0.0548","","","0.1301","0.1592","","","","","","1.004","","","","has coordinates,has disorder","301829","2025-08-20","12:17:40",""
"4068225","10.425","0.003","10.804","0.004","17.325","0.008","97.41","0.006","102.396","0.006","109.684","0.004","1751","1.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H48 B F3 N2 O3 S -","- C33 H48 B F3 N2 O3 S -","- C66 H96 B2 F6 N4 O6 S2 -","2","1","","Wang, Yuzhong; Abraham, Mariham Y.; Gilliard, Robert J.; Wei, Pingrong; Smith, Jared C.; Robinson, Gregory H.","From Anionic N-Heterocyclic Dicarbenes to Abnormal Carbene–Borane Complexes: A Logical Synthetic Route","Organometallics","2012","31","3","791","","10.1021/om201259d","","","0.71073","MoKα","","0.1095","0.0879","","","0.2146","0.2331","","","","","","1.073","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068226","11.596","0.006","15.429","0.008","19.414","0.01","69.981","0.01","77.435","0.012","86.115","0.012","3185","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H38 B F3 N2 O5 S -","- C28 H38 B F3 N2 O5 S -","- C112 H152 B4 F12 N8 O20 S4 -","4","2","","Solovyev, Andrey; Geib, Steven J.; Lacôte, Emmanuel; Curran, Dennis P.","Reactions of Boron-Substituted N-Heterocyclic Carbene Boranes with Triflic Acid. Isolation of a New Dihydroxyborenium Cation","Organometallics","2012","31","1","54","","10.1021/om201260b","","","0.71073","MoKα","","0.1262","0.0722","","","0.1713","0.1971","","","","","","0.959","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068227","17.23","0.002","18.2","0.002","9.9966","0.0013","90","","90","","90","","3134.8","0.6","295","2","295","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C28 H37 B Cl F3 N2 O3 S -","- C28 H36 B Cl F3 N2 O3 S -","- C112 H144 B4 Cl4 F12 N8 O12 S4 -","4","0.5","","Solovyev, Andrey; Geib, Steven J.; Lacôte, Emmanuel; Curran, Dennis P.","Reactions of Boron-Substituted N-Heterocyclic Carbene Boranes with Triflic Acid. Isolation of a New Dihydroxyborenium Cation","Organometallics","2012","31","1","54","","10.1021/om201260b","","","0.71073","MoKα","","0.1219","0.0901","","","0.2474","0.26","","","","","","1.962","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068228","9.639","0.01","10.843","0.012","16.575","0.018","102.184","0.016","101.811","0.017","94.941","0.017","1642","3","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H33 I P2 -","- C41 H33 I P2 -","- C82 H66 I2 P4 -","2","1","","Xu, Chen; Wang, Zhi-Qiang; Li, Zhen; Wang, Wei-Zhou; Hao, Xin-Qi; Fu, Wei-Jun; Gong, Jun-Fang; Ji, Bao-Ming; Song, Mao-Ping","1,3-Diphosphorus Ylide Cyclopentadienylium Salts: Synthesis, Structures, and Application in Coupling Reactions","Organometallics","2012","31","3","798","","10.1021/om201267q","","","0.71073","MoKα","","0.1309","0.0568","","","0.1126","0.1501","","","","","","0.955","","","","has coordinates","301829","2025-08-20","12:17:40",""
"4068229","20.5207","0.0009","16.2535","0.0008","13.8301","0.0007","90","","101.615","0.001","90","","4518.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 Au Cl N2 -","- C11 H12 Au Cl N2 -","- C176 H192 Au16 Cl16 N32 -","16","4","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.0561","0.0471","","","0.1184","0.1221","","","","","","1.106","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068230","17.9194","0.0013","8.1817","0.0006","7.9629","0.0006","90","","90","","90","","1167.45","0.15","223","2","223","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H12 Au Br N2 -","- C11 H12 Au Br N2 -","- C44 H48 Au4 Br4 N8 -","4","1","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.0466","0.0411","","","0.0874","0.0901","","","","","","1.105","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068231","13.7916","0.0006","21.0283","0.0009","13.8291","0.0006","90","","97.836","0.001","90","","3973.2","0.3","223","2","223","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C68 H76 Au6 Cl4 I6 N12 -","- C68 H78 Au6 Cl4 I6 N12 -","- C136 H156 Au12 Cl8 I12 N24 -","2","0.5","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.0513","0.04","","","0.0851","0.0889","","","","","","1.092","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068232","8.76","0.002","9.169","0.002","30.461","0.008","90","","90.124","0.006","90","","2446.6","1","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Au2 I2 N4 -","- C22 H24 Au2 I2 N4 -","- C88 H96 Au8 I8 N16 -","4","1","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.0831","0.0627","","","0.1445","0.1557","","","","","","1.063","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068233","12.501","0.005","11.234","0.005","18.41","0.008","90","","99.032","0.01","90","","2553.4","1.9","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Au B Cl2 F4 N4 -","- C23 H26 Au B Cl2 F4 N4 -","- C92 H104 Au4 B4 Cl8 F16 N16 -","4","1","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.0643","0.0469","","","0.1083","0.1161","","","","","","1.032","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068234","7.8787","0.0007","10.1937","0.0009","20.2478","0.0016","90","","100.431","0.003","90","","1599.3","0.2","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 Au I3 N2 -","- C11 H12 Au I3 N2 -","- C44 H48 Au4 I12 N8 -","4","1","","Sivaram, Haresh; Jothibasu, Ramasamy; Huynh, Han Vinh","Gold Complexes of an Alicyclic Indazole-Derived N-Heterocyclic Carbene: Syntheses, Characterizations, and Ligand Disproportionation","Organometallics","2012","31","3","1195","","10.1021/om201268m","","","0.71073","MoKα","","0.07","0.0554","","","0.141","0.1641","","","","","","1.208","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068235","21.386","0.018","12.908","0.011","18.422","0.015","90","","93.237","0.012","90","","5077","7","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 F6 N2 Ni O -","- C24 H32 F6 N2 Ni O -","- C192 H256 F48 N16 Ni8 O8 -","8","1","","Yamaguchi, Yoshitaka; Ichioka, Hiromi; Klein, Axel; Brennessel, William W.; Vicic, David A.","Linear Bis(perfluoroalkyl) Complexes of Nickel Bipyridine","Organometallics","2012","31","4","1477","","10.1021/om2012776","","","0.71075","MoKα","","","0.0832","","","","0.2823","","","","","","1.026","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068236","13.355","0.003","9.754","0.002","17.601","0.004","90","","93.361","0.005","90","","2288.8","0.9","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","hawdv07","","","- C22 H24 F10 N2 Ni -","- C22 H24 F10 N2 Ni -","- C88 H96 F40 N8 Ni4 -","4","1","","Yamaguchi, Yoshitaka; Ichioka, Hiromi; Klein, Axel; Brennessel, William W.; Vicic, David A.","Linear Bis(perfluoroalkyl) Complexes of Nickel Bipyridine","Organometallics","2012","31","4","1477","","10.1021/om2012776","","","0.71073","MoKα","","0.113","0.0765","","","0.1766","0.1912","","","","","","1.12","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068237","13.9044","0.0015","27.052","0.003","27.707","0.003","90","","91.436","0.002","90","","10418","2","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","hawdv04","","","- C43 H54 Cl8 F10 N4 Ni2 -","- C43 H54 Cl8 F10 N4 Ni2 -","- C344 H432 Cl64 F80 N32 Ni16 -","8","2","","Yamaguchi, Yoshitaka; Ichioka, Hiromi; Klein, Axel; Brennessel, William W.; Vicic, David A.","Linear Bis(perfluoroalkyl) Complexes of Nickel Bipyridine","Organometallics","2012","31","4","1477","","10.1021/om2012776","","","0.71073","MoKα","","0.1205","0.0569","","","0.116","0.1401","","","","","","1.022","","","","has coordinates,has disorder","178572","2020-10-21","18:00:00",""
"4068238","22.629","0.002","9.1394","0.0009","19.2198","0.0018","90","","95.458","0.006","90","","3956.9","0.6","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H47 Cl N2 O2 P2 Ru -","- C45 H47 Cl N2 O2 P2 Ru -","- C180 H188 Cl4 N8 O8 P8 Ru4 -","4","1","","Lund, Clinton L.; Sgro, Michael J.; Cariou, Renan; Stephan, Douglas W.","A Cis-Bis-Mixed-Carbene Ruthenium Hydride Complex: An Olefin-Selective Hydrogenation Catalyst","Organometallics","2012","31","3","802","","10.1021/om300014r","","","0.71073","MoKα","","0.116","0.0582","","","0.1134","0.1353","","","","","","1.02","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068239","13.927","0.002","17.312","0.002","18.966","0.003","90","","107.062","0.006","90","","4371.5","1.1","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H58 Cl N4 O2 P Ru -","- C48 H58 Cl N4 O2 P Ru -","- C192 H232 Cl4 N16 O8 P4 Ru4 -","4","1","","Lund, Clinton L.; Sgro, Michael J.; Cariou, Renan; Stephan, Douglas W.","A Cis-Bis-Mixed-Carbene Ruthenium Hydride Complex: An Olefin-Selective Hydrogenation Catalyst","Organometallics","2012","31","3","802","","10.1021/om300014r","","","0.71073","MoKα","","0.0498","0.0317","","","0.0727","0.0805","","","","","","1.035","","","","has coordinates","178572","2020-10-21","18:00:00",""
"4068240","10.195","0.006","19.852","0.011","16.596","0.009","90","","103.516","0.011","90","","3266","3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H53 Cl2 Ir2 N5 -","- C31.68 H48 N2 Ni -","- C126.72 H192 N8 Ni4 -","4","1","","Wu, Jianguo; Faller, John W.; Hazari, Nilay; Schmeier, Timothy J.","Stoichiometric and Catalytic Reactions of Thermally Stable Nickel(0) NHC Complexes","Organometallics","2012","31","3","806","","10.1021/om300045t","","","0.71075","MoKα","","0.1478","0.0727","","","0.1509","0.1887","","","","","","0.971","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4068241","16.71","0.0017","17.2639","0.0014","16.7365","0.0014","90","","90.869","0.006","90","","4827.6","0.7","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H34 N2 Ni -","- C27 H34 N2 Ni -","- C216 H272 N16 Ni8 -","8","2","","Wu, Jianguo; Faller, John W.; Hazari, Nilay; Schmeier, Timothy J.","Stoichiometric and Catalytic Reactions of Thermally Stable Nickel(0) NHC Complexes","Organometallics","2012","31","3","806","","10.1021/om300045t","","","1.54187","CuKα","","","0.0634","","","","0.198","","","","","","1.145","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068242","49.386","0.003","10.1943","0.0007","39.932","0.003","90","","111.978","0.008","90","","18643","2","93","","93","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H46 N2 Ni O -","- C33 H46 N2 Ni O -","- C792 H1104 N48 Ni24 O24 -","24","3","","Wu, Jianguo; Faller, John W.; Hazari, Nilay; Schmeier, Timothy J.","Stoichiometric and Catalytic Reactions of Thermally Stable Nickel(0) NHC Complexes","Organometallics","2012","31","3","806","","10.1021/om300045t","","","1.54187","CuKα","","","0.1151","","","","0.3144","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4068243","11.7681","0.0018","12.222","0.0019","12.814","0.002","91.175","0.004","91.489","0.004","93.016","0.004","1839.4","0.5","223","","223","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H54 N2 Ni O Si2 -","- C35 H54 N2 Ni O Si2 -","- C70 H108 N4 Ni2 O2 Si4 -","2","1","","Wu, Jianguo; Faller, John W.; Hazari, Nilay; Schmeier, Timothy J.","Stoichiometric and Catalytic Reactions of Thermally Stable Nickel(0) NHC Complexes","Organometallics","2012","31","3","806","","10.1021/om300045t","","","0.71075","MoKα","","","0.0494","","","","0.1031","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076307","10.7646","0.0004","32.2519","0.0008","13.6095","0.0005","90","","104.14","0.003","90","","4581.8","0.3","120","2","120","2","","","","","","","synthesis as described","5","P 1 21/a 1","-P 2yab","14","","","","- C56 H53 Fe N P2 -","- C56 H53 Fe N P2 -","- C224 H212 Fe4 N4 P8 -","4","1","","Grelaud, Guillaume; Cador, Olivier; Roisnel, Thierry; Argouarch, Gilles; Cifuentes, Marie P.; Humphrey, Mark G.; Paul, Frédéric","Triphenylamine Derivatives with Para-Disposed Pendant Electron-Rich Organoiron Alkynyl Substituents: Defining the Magnetic Interactions in a Trinuclear Iron(III) Trication","Organometallics","2012","31","5","1635","","10.1021/om2006358","","x-ray","0.71073","MoKα","","0.0926","0.0513","","","0.1244","0.133","","","","","","1.036","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076308","15.5966","0.0002","10.6035","0.0001","16.5766","0.0002","90","","109.682","0.001","90","","2581.25","0.05","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H33 Cl2 Cr N2 -","- C28 H33 Cl2 Cr N2 -","- C112 H132 Cl8 Cr4 N8 -","4","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.0487","0.0398","","","0.0933","0.0991","","","","","","1.079","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076309","12.7984","0.0005","7.4565","0.0003","28.4004","0.0011","90","","98.134","0.002","90","","2683.02","0.18","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H35 Cl2 Cr N2 -","- C29 H35 Cl2 Cr N2 -","- C116 H140 Cl8 Cr4 N8 -","4","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","x-ray","0.71073","MoKα","","0.0855","0.069","","","0.1624","0.1757","","","","","","1.077","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076310","10.211","0.002","21.9","0.004","15.64","0.003","90","","107.4","0.03","90","","3337.4","1.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 Cl Cr N2 -","- C34 H38 Cl Cr N2 -","- C136 H152 Cl4 Cr4 N8 -","4","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.6939","synchrotron","","0.1172","0.0852","","","0.2513","0.2706","","","","","","1.102","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076311","22.7359","0.0011","16.9398","0.0008","14.8727","0.0006","90","","90","","90","","5728.1","0.5","153","2","153","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C31 H40 Cl Cr N2 O0.5 -","- C31 H40 Cl Cr N2 O0.5 -","- C248 H320 Cl8 Cr8 N16 O4 -","8","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.1368","0.1007","","","0.2645","0.2876","","","","","","1.103","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076312","25.109","0.018","11.132","0.008","35.019","0.018","90","","133.97","0.03","90","","7045","9","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H47 Cr N2 -","- C42 H47 Cr N2 -","- C336 H376 Cr8 N16 -","8","2","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","x-ray","0.71073","","","0.0879","0.0609","","","0.1544","0.1684","","","","","","1.01","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076313","12.747","","12.747","","33.708","","90","","90","","120","","4743.29","","120","2","120","2","","","","","","","","8","P 32","P 32","145","","","","- C65 H55 B Cl Cr F24 N2 O -","- C65 H55 B Cl Cr F24 N2 O -","- C195 H165 B3 Cl3 Cr3 F72 N6 O3 -","3","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.2173","0.0958","","","0.217","0.2767","","","","","","1.006","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076314","12.6125","0.0014","15.1254","0.0013","21.731","0.002","107.063","0.006","93.236","0.004","97.023","0.005","3914.7","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C71 H60 B Cr F24 N2 O -","- C71 H60 B Cr F24 N2 O -","- C142 H120 B2 Cr2 F48 N4 O2 -","2","1","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","x-ray","0.71073","MoKα","","0.249","0.1356","","","0.3222","0.3816","","","","","","1.016","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076315","14.1911","0.0005","22.616","0.0007","15.8258","0.0005","90","","89.983","0.002","90","","5079.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H33 Cl Cr N2 -","- C28 H33 Cl Cr N2 -","- C224 H264 Cl8 Cr8 N16 -","8","2","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.1098","0.0615","","","0.1122","0.1282","","","","","","1.032","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076316","31.7161","0.0005","31.7161","0.0005","31.7161","0.0005","90","","90","","90","","31903.6","0.9","153","2","153","2","","","","","","","","6","I a -3","-I 2b 2c 3","206","","","","- C56 H66 Cl2 Cr2 N4 O -","- C56 H66 Cl2 Cr2 N4 O -","- C1344 H1584 Cl48 Cr48 N96 O24 -","24","0.5","","Conde-Guadano, Susana; Danopoulos, Andreas A.; Pattacini, Roberto; Hanton, Martin; Tooze, Robert P.","Indenyl Functionalized N-Heterocyclic Carbene Complexes of Chromium: Syntheses, Structures, and Reactivity Studies Relevant to Ethylene Oligomerization and Polymerization","Organometallics","2012","31","5","1643","","10.1021/om200641u","","","0.71073","MoKα","","0.2179","0.1354","","","0.2492","0.2844","","","","","","1.173","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076317","11.3","0.0003","11.3","0.0003","28.1345","0.0018","90","","90","","90","","3592.5","0.3","173","2","173","2","","","","","","","","4","P 41","P 4w","76","","","","- C38 H18 Co4 O12 -","- C38 H18 Co4 O12 -","- C152 H72 Co16 O48 -","4","1","","Melikyan, Gagik G.; Rivas, Bianca; Harutyunyan, Stepan; Carlson, Louis; Sepanian, Ruth","Cobaltocene-Induced Low-Temperature Radical Coupling Reactions in a Cobalt‒Alkyne Series","Organometallics","2012","31","5","1653","","10.1021/om2006497","","","1.54178","CuKα","","0.138","0.092","","","0.248","0.2777","","","","","","1.05","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076318","11.8926","0.0004","19.5888","0.0006","7.6155","0.0003","90","","90","","90","","1774.12","0.11","173","2","173","2","","","","","","","","2","P c a 21","P 2c -2ac","29","","","","- C26 H18 -","- C26 H18 -","- C104 H72 -","4","1","","Melikyan, Gagik G.; Rivas, Bianca; Harutyunyan, Stepan; Carlson, Louis; Sepanian, Ruth","Cobaltocene-Induced Low-Temperature Radical Coupling Reactions in a Cobalt–Alkyne Series","Organometallics","2012","31","5","1653","","10.1021/om2006497","","","1.54178","CuKα","","0.058","0.0419","","","0.0867","0.0929","","","","","","1.03","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076319","10.5185","0.0001","11.146","0.0001","16.7776","0.0002","90","","90","","90","","1966.99","0.03","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 Cl N4 Pt -","- C20 H25 Cl N4 Pt -","- C80 H100 Cl4 N16 Pt4 -","4","1","","Zhang, Xiaofei; Wright, Ashley M.; DeYonker, Nathan J.; Hollis, T. Keith; Hammer, Nathan I.; Webster, Charles Edwin; Valente, Edward J.","Synthesis, Air Stability, Photobleaching, and DFT Modeling of Blue Light Emitting Platinum CCC-N-Heterocyclic Carbene Pincer Complexes","Organometallics","2012","31","5","1664","","10.1021/om200687w","","","0.71073","MoKα","","0.02","0.0169","","","0.0317","0.0319","","","","","","1.003","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076320","10.314","0.0001","11.1814","0.0002","16.9083","0.0002","90","","90","","90","","1949.95","0.05","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 Br N4 Pt -","- C20 H25 Br N4 Pt -","- C80 H100 Br4 N16 Pt4 -","4","1","","Zhang, Xiaofei; Wright, Ashley M.; DeYonker, Nathan J.; Hollis, T. Keith; Hammer, Nathan I.; Webster, Charles Edwin; Valente, Edward J.","Synthesis, Air Stability, Photobleaching, and DFT Modeling of Blue Light Emitting Platinum CCC-N-Heterocyclic Carbene Pincer Complexes","Organometallics","2012","31","5","1664","","10.1021/om200687w","","","0.71073","MoKα","","0.0419","0.0299","","","0.0639","0.0716","","","","","","1.009","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076321","6.9519","0.0002","8.8643","0.0004","30.6884","0.0009","87.744","0.003","87.644","0.002","77.553","0.003","1844.22","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H37 Co O8 -","- C46 H37 Co O8 -","- C92 H74 Co2 O16 -","2","1","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.1128","0.0543","","","0.0969","0.1091","","","","","","0.973","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076322","12.948","0.003","32.013","0.003","9.058","0.002","90","","90","","90","","3754.6","1.3","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C46 H39 Co O9 -","- C46 H34 Co O9 -","- C184 H136 Co4 O36 -","4","0.5","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.1129","0.0864","","","0.2495","0.2866","","","","","","1.038","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076323","15.9614","0.0009","9.8616","0.0005","14.7153","0.0009","90","","105.083","0.007","90","","2236.5","0.2","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C28 H23 Co O4 -","- C28 H23 Co O4 -","- C112 H92 Co4 O16 -","4","1","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.059","0.0412","","","0.0791","0.0833","","","","","","0.934","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076324","9.4461","0.0015","22.886","0.004","17.238","0.003","90","","100.653","0.018","90","","3662.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H37 Co O8 -","- C46 H37 Co O8 -","- C184 H148 Co4 O32 -","4","1","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.2035","0.0524","","","0.0816","0.1011","","","","","","0.693","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076325","12.4741","0.0004","14.4931","0.0004","17.3434","0.0005","87.648","0.002","88.802","0.002","80.041","0.002","3085.33","0.16","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H43 Co O4 -","- C38 H43 Co O4 -","- C152 H172 Co4 O16 -","4","2","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.1479","0.1115","","","0.3055","0.3149","","","","","","1.026","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076326","14.0376","0.0007","19.4515","0.0006","14.9838","0.0007","90","","118.555","0.006","90","","3593.7","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H26 Co0.5 O4 -","- C19 H21.5 Co0.5 O4 -","- C152 H172 Co4 O32 -","8","1","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.1077","0.0643","","","0.1649","0.1798","","","","","","0.937","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076327","16.3726","0.0009","9.9754","0.0006","14.5407","0.0008","90","","104.215","0.006","90","","2302.1","0.2","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","organometallic network","","","- C30 H25 Cr O4 -","- C30 H25 Cr O4 -","- C120 H100 Cr4 O16 -","4","1","","Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia","Shape Takes the Lead: Templating Organic 3D-Frameworks around Organometallic Sandwich Compounds","Organometallics","2012","31","5","1688","","10.1021/om200837t","","","0.71073","MoKα","","0.0823","0.0487","","","0.0881","0.0941","","","","","","0.989","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076328","16.671","0.002","10.964","0.002","27.6144","0.0018","90","","95.12","0.008","90","","5027.2","1.1","150","2","150","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H17 Cl7 N4 O4 Ru -","- C16 H17 Cl7 N4 O4 Ru -","- C128 H136 Cl56 N32 O32 Ru8 -","8","1","","Türkoglu, Gazi; Tampier, Stefan; Strinitz, Frank; Heinemann, Frank W.; Hübner, Eike; Burzlaff, Nicolai","Ruthenium Carbonyl Complexes Bearing Bis(pyrazol-1-yl)carboxylato Ligands","Organometallics","2012","31","6","2166","","10.1021/om2009155","","x-ray","0.71073","MoKα","","0.0355","0.0283","","","0.0818","0.0847","","","","","","1.206","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076329","8.2954","0.0007","9.6359","0.0004","11.5264","0.0007","106.284","0.005","99.128","0.006","104.417","0.004","830.27","0.1","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C15 H17 Cl N4 O4 Ru -","- C15 H17 Cl N4 O4 Ru -","- C30 H34 Cl2 N8 O8 Ru2 -","2","1","","Türkoglu, Gazi; Tampier, Stefan; Strinitz, Frank; Heinemann, Frank W.; Hübner, Eike; Burzlaff, Nicolai","Ruthenium Carbonyl Complexes Bearing Bis(pyrazol-1-yl)carboxylato Ligands","Organometallics","2012","31","6","2166","","10.1021/om2009155","","x-ray","0.71073","MoKα","","0.0265","0.0228","","","0.0573","0.0588","","","","","","1.096","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076330","8.8301","0.0006","28.597","0.002","10.3379","0.0008","90","","114.173","0.005","90","","2381.6","0.3","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 Cl12 N8 O8 Ru2 -","- C32 H34 Cl12 N8 O8 Ru2 -","- C64 H68 Cl24 N16 O16 Ru4 -","2","0.5","","Türkoglu, Gazi; Tampier, Stefan; Strinitz, Frank; Heinemann, Frank W.; Hübner, Eike; Burzlaff, Nicolai","Ruthenium Carbonyl Complexes Bearing Bis(pyrazol-1-yl)carboxylato Ligands","Organometallics","2012","31","6","2166","","10.1021/om2009155","","x-ray","0.71073","MoKα","","0.0577","0.0455","","","0.113","0.1238","","","","","","1.169","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076331","30.18","0.006","12.912","0.003","28.568","0.006","90","","93.67","0.03","90","","11110","4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","(η^3^-Allyl)-{1-(2-picolyl)-3-(phenyl)-imidazolylidene-κ^2^ N,C}-nickel (II) tetrakis{3,5-bis(trifluoromethyl)phenyl}borate dichloromethane diethylether solvate","","","- C54 H40 B F24 N3 Ni O -","- C54 H40 B F24 N3 Ni O -","- C432 H320 B8 F192 N24 Ni8 O8 -","8","1","","Ben\?ítez Junquera, Lourdes; Puerta, M. Carmen; Valerga, Pedro","R-Allyl Nickel(II) Complexes with Chelating N-Heterocyclic Carbenes: Synthesis, Structural Characterization, and Catalytic Activity","Organometallics","2012","31","6","2175","","10.1021/om200937d","","x-ray","0.71073","MoKα","","0.1076","0.0982","","","0.2305","0.2373","","","","","","1.079","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076332","15.0183","0.0001","10.4278","0.0001","35.8282","0.0003","90","","101.38","0.0005","90","","5500.68","0.08","150","2","150","2","","","","","","","synthesized by the authors","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H25 B18 Co O -","- C6 H25 B18 Co O -","- C72 H300 B216 Co12 O12 -","12","3","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.7107","MoKα","","0.0493","0.0354","","","0.0807","0.0861","","","","","","1.048","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076333","13.3333","0.0002","12.9059","0.0002","13.5899","0.0002","90","","105.958","0.0008","90","","2248.41","0.06","150","2","150","2","","","","","","","synthesized by the authors","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H30 B18 Co N O -","- C11 H30 B18 Co N O -","- C44 H120 B72 Co4 N4 O4 -","4","1","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.7107","MoKα","","0.0288","0.0251","","","0.0629","0.0647","","","","","","1.047","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076334","10.6296","0.0001","9.9113","0.0001","23.2108","0.0003","90","","93.3422","0.0006","90","","2441.17","0.05","150","2","150","2","","","","","","","synthesized by the authors","7","P 1 21/c 1","-P 2ybc","14","","","","- C9 H34 B18 Cl2 Co N O2 -","- C9 H34 B18 Cl2 Co N O2 -","- C36 H136 B72 Cl8 Co4 N4 O8 -","4","1","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.71073","MoKα","","0.0288","0.0247","","","0.0636","0.0659","","","","","","1.041","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076335","38.2599","0.0003","12.9046","0.0001","34.232","0.0003","90","","123.695","0.0004","90","","14061.9","0.2","150","2","150","2","","","","","","","synthesized by the authors","7","C 1 2/c 1","-C 2yc","15","","","","- C24.5 H40.5 B18 Cl1.5 Co O P -","- C24 H40 B18 Co O P -","- C384 H640 B288 Co16 O16 P16 -","16","2","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.71073","MoKα","","0.049","0.0361","","","0.0989","0.1048","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076336","29.155","0.0002","7.113","0.0004","11.592","0.0007","90","","90","","90","","2403.9","0.2","150","2","150","2","","","","","","","synthesized by the authors","6","P n a 21","P 2c -2n","33","","","","- C11 H38 B18 Co N O -","- C11 H38 B18 Co N O -","- C44 H152 B72 Co4 N4 O4 -","4","1","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.71073","MoKα","","0.0398","0.0327","","","0.0736","0.078","","","","","","1.046","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076337","14.5021","0.0002","18.3083","0.0003","31.5734","0.0005","94.4656","0.0011","99.342","0.001","107.188","0.0007","7831.7","0.2","150","2","150","2","","","","","","","synthesized by the authors","8","P -1","-P 1","2","","","","- C58.5 H87.5 B18 Cl10.5 Co Cs N2 O5 -","- C57.75 H86.75 B18 Cl8.25 Co Cs N2 O5 -","- C231 H347 B72 Cl33 Co4 Cs4 N8 O20 -","4","2","","Plešek, Jaromír; Grüner, Bohumír; Šícha, Václav; Bőhmer, Volker; Císařová, Ivana","The Zwitterion [8,8′-μ-CH2O(CH3)-(1,2-C2B9H10)2-3,3′-Co]0as a Versatile Building Block To Introduce Cobalt Bis(Dicarbollide) Ion into Organic Molecules","Organometallics","2012","31","5","1703","","10.1021/om200938n","","","0.71073","MoKα","","0.1093","0.0822","","","0.2236","0.24","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076338","7.434","0.002","10.147","0.003","12.988","0.003","90","","101.579","0.006","90","","959.8","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 -","- C13 H10 N2 -","- C52 H40 N8 -","4","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.0637","0.0403","","","0.0957","0.1069","","","","","","1.03","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076339","16.835","0.0011","10.0153","0.0006","23.5193","0.0014","90","","90","","90","","3965.5","0.4","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C25 H21 N2 P -","- C25 H21 N2 P -","- C200 H168 N16 P8 -","8","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.1408","0.0564","","","0.1143","0.1423","","","","","","1.013","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076340","12.4037","0.0008","20.65","0.0014","18.9656","0.0014","90","","98.46","0.004","90","","4804.9","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H64 Cu N4 O P -","- C56 H64 Cu N4 O P -","- C224 H256 Cu4 N16 O4 P4 -","4","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.1474","0.0588","","","0.118","0.1483","","","","","","0.996","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076341","11.7744","0.0006","26.7682","0.0015","12.3243","0.0006","90","","91.391","0.003","90","","3883.2","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H45 N2 O P2 Rh -","- C47 H45 N2 O P2 Rh -","- C188 H180 N8 O4 P8 Rh4 -","4","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.0701","0.0391","","","0.0757","0.0865","","","","","","1.002","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076342","15.888","0.003","11.603","0.002","16.131","0.003","90","","118.29","0.03","90","","2618.5","1.1","396","2","396","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H64 N4 P2 Rh2 -","- C66 H64 N4 P2 Rh2 -","- C132 H128 N8 P4 Rh4 -","2","0.5","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.04","0.0292","","","0.0668","0.071","","","","","","1.041","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076343","11.4556","0.0005","13.7682","0.0006","14.6843","0.0005","90","","104.622","0.002","90","","2241.04","0.16","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H40 Au2 N4 P2 -","- C50 H40 Au2 N4 P2 -","- C100 H80 Au4 N8 P4 -","2","0.5","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.0668","0.0368","","","0.0674","0.0732","","","","","","0.962","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076344","26.8211","0.0009","18.0574","0.0008","21.79","0.001","90","","106.575","0.002","90","","10114.8","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51.5 H43.5 Au Cl N4 P2 -","- C51.5 H43.5 Au Cl N4 P2 -","- C412 H348 Au8 Cl8 N32 P16 -","8","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.0931","0.0483","","","0.1044","0.1153","","","","","","0.957","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076345","20.1203","0.0008","15.9161","0.0006","18.5991","0.0007","90","","104.265","0.002","90","","5772.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H80 Au N4 O3 P -","- C64 H80 Au N4 O3 P -","- C256 H320 Au4 N16 O12 P4 -","4","1","","Tan, Runyu; Chiu, Frederick Sin Nang; Hadzovic, Alen; Song, Datong","Construction of Rhodium(I) and Gold(I) Macrocycles by Transferring a Phosphine-Functionalized 4,5-Diazafluorenide Ligand from Its Copper(I) N-Heterocyclic Carbene Complex","Organometallics","2012","31","6","2184","","10.1021/om200994b","","","0.71073","MoKα","","0.0519","0.0302","","","0.0622","0.07","","","","","","1.003","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076346","9.298","0.0004","12.3701","0.0004","10.5919","0.0004","90","","101.32","0.003","90","","1194.55","0.08","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Br2 Mo2 N2 O8 -","- C18 H20 Br2 Mo2 N2 O8 -","- C36 H40 Br4 Mo4 N4 O16 -","2","0.5","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0501","0.0338","","","0.0664","0.0735","","","","","","1.109","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076347","10.127","0.0004","10.762","0.0004","10.8101","0.0005","66.654","0.004","77.431","0.004","84.127","0.004","1055.61","0.08","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C20 H28 Mo N2 O4 -","- C20 H28 Mo N2 O4 -","- C40 H56 Mo2 N4 O8 -","2","1","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0255","0.0217","","","0.0511","0.0536","","","","","","1.094","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076348","33.987","0.0012","7.267","0.0006","13.8271","0.0012","90","","94.584","0.005","90","","3404.1","0.4","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Mo O8 -","- C16 H16 Mo O8 -","- C128 H128 Mo8 O64 -","8","2","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0653","0.0463","","","0.0867","0.0935","","","","","","1.161","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076349","7.5069","0.0005","9.912","0.0005","10.4911","0.0008","82.833","0.005","75.196","0.005","72.82","0.004","720.01","0.08","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 Mo O6 -","- C14 H14 Mo O6 -","- C28 H28 Mo2 O12 -","2","1","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0456","0.0368","","","0.0838","0.0883","","","","","","1.12","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076350","21.3469","0.0003","7.45","0.0006","10.1251","0.0011","90","","90","","90","","1610.2","0.2","150","1","150","1","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C11 H14 B F4 Mo N3 O2 -","- C11 H14 B F4 Mo N3 O2 -","- C44 H56 B4 F16 Mo4 N12 O8 -","4","1","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0347","0.0279","","","0.0657","0.0697","","","","","","1.052","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076351","27.3613","0.0011","13.479","0.0003","10.7391","0.0008","90","","107.741","0.005","90","","3772.3","0.3","150","1","150","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C13 H16 B F4 Mo N3 O4 -","- C13 H16 B F4 Mo N3 O4 -","- C104 H128 B8 F32 Mo8 N24 O32 -","8","1","","Honzíček, Jan; Kratochvíl, Pavel; Vinklárek, Jaromír; Eisner, Aleš; Padělková, Zdeňka","Effect of the Substitution on the Protonation of Allyl Cyclopentadienyl Molybdenum(II) Compounds","Organometallics","2012","31","6","2193","","10.1021/om2010244","","","0.71073","MoKα","","0.0616","0.0384","","","0.0665","0.0747","","","","","","1.109","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076352","10.241","0.0008","10.348","0.0006","18.2559","0.0009","88.854","0.005","88.549","0.006","62.66","0.005","1717.9","0.2","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C25 H40 As2 Cl2 N4 O5 Sb2 -","- C25 H40 As2 Cl2 N4 O5 Sb2 -","- C50 H80 As4 Cl4 N8 O10 Sb4 -","2","1","","Svoboda, Tomáš; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Lyčka, Antonín; Proft, Frank De; Dostál, Libor","Reactivity of NCN-Chelated (NCN = C6H3-2,6-(CH2NMe2)2) Antimony(III) and Bismuth(III) Oxides toward Oxides of Arsenic","Organometallics","2012","31","5","1725","","10.1021/om201025d","","","0.71073","MoKα","","0.0608","0.0343","","","0.0556","0.0615","","","","","","1.035","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076353","10.2801","0.0006","10.393","0.0004","18.4839","0.0014","89.888","0.005","88.76","0.006","61.948","0.004","1742.35","0.19","150","1","150","1","","","","","","","","7","P -1","-P 1","2","","","","- C25 H40 As2 Bi2 Cl2 N4 O5 -","- C25 H40 As2 Bi2 Cl2 N4 O5 -","- C50 H80 As4 Bi4 Cl4 N8 O10 -","2","1","","Svoboda, Tomáš; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Lyčka, Antonín; Proft, Frank De; Dostál, Libor","Reactivity of NCN-Chelated (NCN = C6H3-2,6-(CH2NMe2)2) Antimony(III) and Bismuth(III) Oxides toward Oxides of Arsenic","Organometallics","2012","31","5","1725","","10.1021/om201025d","","","0.71073","MoKα","","0.0569","0.0415","","","0.0958","0.1058","","","","","","1.113","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076354","8.7223","0.0017","11.066","0.002","16.689","0.003","90","","98.83","0.03","90","","1591.7","0.5","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 Co N2 -","- C16 H25 Co N2 -","- C64 H100 Co4 N8 -","4","1","","Dürr, Simon; Zarzycki, Bartosz; Ertler, Daniel; Ivanović-Burmazović, Ivana; Radius, Udo","Aerobic CO Oxidation of a Metal-Bound Carbonyl in a NHC-Stabilized Cobalt Half-Sandwich Complex","Organometallics","2012","31","5","1730","","10.1021/om201037w","","","0.71073","MoKα","","0.053","0.0348","","","0.0757","0.0831","","","","","","1.044","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076355","8.9818","0.0018","13.696","0.003","16.921","0.003","90","","90.18","0.03","90","","2081.5","0.7","203","2","203","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H35 Co N2 -","- C21 H35 Co N2 -","- C84 H140 Co4 N8 -","4","1","","Dürr, Simon; Zarzycki, Bartosz; Ertler, Daniel; Ivanović-Burmazović, Ivana; Radius, Udo","Aerobic CO Oxidation of a Metal-Bound Carbonyl in a NHC-Stabilized Cobalt Half-Sandwich Complex","Organometallics","2012","31","5","1730","","10.1021/om201037w","","","0.71073","MoKα","","0.0466","0.0338","","","0.083","0.0877","","","","","","1.052","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076356","12.081","0.002","9.89","0.002","13.083","0.003","90","","90","","90","","1563.2","0.5","203","2","203","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C15 H21 Co N2 O -","- C15 H21 Co N2 O -","- C60 H84 Co4 N8 O4 -","4","1","","Dürr, Simon; Zarzycki, Bartosz; Ertler, Daniel; Ivanović-Burmazović, Ivana; Radius, Udo","Aerobic CO Oxidation of a Metal-Bound Carbonyl in a NHC-Stabilized Cobalt Half-Sandwich Complex","Organometallics","2012","31","5","1730","","10.1021/om201037w","","","0.71073","MoKα","","0.0359","0.0298","","","0.068","0.0737","","","","","","1.087","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076357","9.0775","0.0018","13.17","0.003","16.912","0.003","90","","91.75","0.03","90","","2020.9","0.7","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H31 Co N2 O -","- C20 H31 Co N2 O -","- C80 H124 Co4 N8 O4 -","4","1","","Dürr, Simon; Zarzycki, Bartosz; Ertler, Daniel; Ivanović-Burmazović, Ivana; Radius, Udo","Aerobic CO Oxidation of a Metal-Bound Carbonyl in a NHC-Stabilized Cobalt Half-Sandwich Complex","Organometallics","2012","31","5","1730","","10.1021/om201037w","","","0.71073","MoKα","","0.0503","0.0362","","","0.0859","0.0928","","","","","","1.013","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076358","10.755","0.002","10.104","0.002","18.75","0.004","90","","96.78","0.03","90","","2023.3","0.7","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H31 Co N2 O3 -","- C20 H31 Co N2 O3 -","- C80 H124 Co4 N8 O12 -","4","1","","Dürr, Simon; Zarzycki, Bartosz; Ertler, Daniel; Ivanović-Burmazović, Ivana; Radius, Udo","Aerobic CO Oxidation of a Metal-Bound Carbonyl in a NHC-Stabilized Cobalt Half-Sandwich Complex","Organometallics","2012","31","5","1730","","10.1021/om201037w","","","0.71073","MoKα","","0.1254","0.0527","","","0.0849","0.1048","","","","","","0.931","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076359","19.74","0.004","13.033","0.002","11.766","0.002","90","","90.618","0.015","90","","3026.9","0.9","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C62 H52 Cl4 N2 P4 Pt Te2 -","- C62 H52 Cl4 N2 P4 Pt Te2 -","- C124 H104 Cl8 N4 P8 Pt2 Te4 -","2","0.5","","Chauhan, Rohit Singh; Kedarnath, G.; Wadawale, Amey; Rheingold, Arnold L.; Muñoz-Castro, Alvaro; Arratia-Perez, Ramiro; Jain, Vimal K.","Reactivity of Dipyridyl Ditellurides with (Diphosphine)Pt0and 2-Pyridyltellurolates with (Diphosphine)PtCl2and Isolation of Different Structural Motifs of Platinum(II) Complexes","Organometallics","2012","31","5","1743","","10.1021/om2010589","","","0.71069","MoKα","","0.0857","0.0514","","","0.1267","0.1478","","","","","","1.04","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076360","30.256","0.004","16.828","0.002","22.048","0.005","90","","123.007","0.002","90","","9414","3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C112 H100 B2 N2 P4 Pt2 Te2 -","- C112 H100 B2 N2 P4 Pt2 Te2 -","- C448 H400 B8 N8 P16 Pt8 Te8 -","4","0.5","","Chauhan, Rohit Singh; Kedarnath, G.; Wadawale, Amey; Rheingold, Arnold L.; Muñoz-Castro, Alvaro; Arratia-Perez, Ramiro; Jain, Vimal K.","Reactivity of Dipyridyl Ditellurides with (Diphosphine)Pt0and 2-Pyridyltellurolates with (Diphosphine)PtCl2and Isolation of Different Structural Motifs of Platinum(II) Complexes","Organometallics","2012","31","5","1743","","10.1021/om2010589","","","0.71073","MoKα","","0.0475","0.0287","","","0.0599","0.0666","","","","","","1.017","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076361","7.2873","0.0008","7.7101","0.0008","15.1225","0.0016","90","","101.933","0.002","90","","831.31","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1,3-Dimethyl-2,3-dihydro-1<i>H</i>-imidazol-2-ylidene-κ<i>C</i>^2^)trifluoroboron","","- C6 H10 B F3 N2 -","- C6 H10 B F3 N2 -","- C24 H40 B4 F12 N8 -","4","1","","Tian, Chong; Nie, Wanli; Borzov, Maxim V.; Su, Pengfei","High-Yield Thermolytic Conversion of Imidazolium Salts into Arduengo Carbene Adducts with BF3and PF5","Organometallics","2012","31","5","1751","","10.1021/om201086d","","","0.71073","MoKα","","0.0685","0.0391","","","0.0957","0.1046","","","","","","1.065","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076362","7.2918","0.0015","7.7091","0.0015","15.126","0.003","90","","101.935","0.003","90","","831.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(1-Ethyl-3-methyl-2,3-dihydro-1<i>H</i>-imidazol-2-yl-idene-κ<i>C</i>^2^)trifluoroboron","","- C6 H10 B F3 N2 -","- C6 H10 B F3 N2 -","- C24 H40 B4 F12 N8 -","4","1","","Tian, Chong; Nie, Wanli; Borzov, Maxim V.; Su, Pengfei","High-Yield Thermolytic Conversion of Imidazolium Salts into Arduengo Carbene Adducts with BF3and PF5","Organometallics","2012","31","5","1751","","10.1021/om201086d","","","0.71073","MoKα","","0.0677","0.0417","","","0.1027","0.11","","","","","","1.054","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076363","7.1365","0.0008","15.0684","0.0016","7.7793","0.0009","90","","92.141","0.002","90","","835.97","0.16","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1,3-Dimethyl-2,3-dihydro-1<i>H</i>-imidazol-2-ylidene-κ<i>C</i>^2^)pentafluorophosphorous","","- C5 H8 F5 N2 P -","- C5 H8 F5 N2 P -","- C20 H32 F20 N8 P4 -","4","1","","Tian, Chong; Nie, Wanli; Borzov, Maxim V.; Su, Pengfei","High-Yield Thermolytic Conversion of Imidazolium Salts into Arduengo Carbene Adducts with BF3and PF5","Organometallics","2012","31","5","1751","","10.1021/om201086d","","","0.71073","MoKα","","0.0508","0.0394","","","0.1239","0.131","","","","","","1.142","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076364","8.3723","0.0012","7.5087","0.001","14.914","0.002","90","","94.799","0.004","90","","934.3","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(1,3-Dimethyl-1<i>H</i>-imidazolium-2-yl)methylpentafluorophosphate","","- C6 H10 F5 N2 P -","- C6 H10 F5 N2 P -","- C24 H40 F20 N8 P4 -","4","1","","Tian, Chong; Nie, Wanli; Borzov, Maxim V.; Su, Pengfei","High-Yield Thermolytic Conversion of Imidazolium Salts into Arduengo Carbene Adducts with BF3and PF5","Organometallics","2012","31","5","1751","","10.1021/om201086d","","","0.71073","MoKα","","0.0924","0.0574","","","0.1501","0.1659","","","","","","1.063","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076365","24.0972","0.0012","11.339","0.0007","17.701","0.0008","90","","100.487","0.004","90","","4755.8","0.4","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H64 N6 Si4 Sn -","- C42 H64 N6 Si4 Sn -","- C168 H256 N24 Si16 Sn4 -","4","1","","Chlupatý, Tomáš; Padělková, Zdeňka; DeProft, Frank; Willem, Rudolph; Růžička, Aleš","Addition of Lappert's Stannylenes to Carbodiimides, Providing a New Class of Tin(II) Guanidinates","Organometallics","2012","31","6","2203","","10.1021/om201118m","","","0.71073","MoKα","","0.0576","0.0356","","","0.0657","0.0762","","","","","","1.098","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076366","9.964","0.0005","11.0551","0.0005","13.6129","0.0005","68.42","0.003","77.555","0.003","68.335","0.004","1290.37","0.11","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C21 H32 Cl N3 Si2 Sn -","- C21 H32 Cl N3 Si2 Sn -","- C42 H64 Cl2 N6 Si4 Sn2 -","2","1","","Chlupatý, Tomáš; Padělková, Zdeňka; DeProft, Frank; Willem, Rudolph; Růžička, Aleš","Addition of Lappert's Stannylenes to Carbodiimides, Providing a New Class of Tin(II) Guanidinates","Organometallics","2012","31","6","2203","","10.1021/om201118m","","","0.71073","MoKα","","0.0276","0.0223","","","0.0504","0.0538","","","","","","1.094","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076367","17.895","0.0004","17.895","0.0019","16.1841","0.0002","90","","90","","90","","5182.7","0.6","150","1","150","1","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C19 H40 Cl N3 Si2 Sn -","- C19 H40 Cl N3 Si2 Sn -","- C152 H320 Cl8 N24 Si16 Sn8 -","8","1","","Chlupatý, Tomáš; Padělková, Zdeňka; DeProft, Frank; Willem, Rudolph; Růžička, Aleš","Addition of Lappert's Stannylenes to Carbodiimides, Providing a New Class of Tin(II) Guanidinates","Organometallics","2012","31","6","2203","","10.1021/om201118m","","","0.71073","MoKα","","0.05","0.0322","","","0.0557","0.0649","","","","","","1.177","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076368","12.603","0.0009","12.742","0.0007","14.1991","0.0011","79.35","0.005","64.789","0.006","75.427","0.005","1988.8","0.3","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C58 H110 N8 O3 Si8 Sn2 -","- C62 H120 N8 O4 Si8 Sn2 -","- C62 H120 N8 O4 Si8 Sn2 -","1","0.5","","Chlupatý, Tomáš; Padělková, Zdeňka; DeProft, Frank; Willem, Rudolph; Růžička, Aleš","Addition of Lappert's Stannylenes to Carbodiimides, Providing a New Class of Tin(II) Guanidinates","Organometallics","2012","31","6","2203","","10.1021/om201118m","","","0.71073","MoKα","","0.0757","0.0545","","","0.12","0.1331","","","","","","1.181","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076369","12.496","0.0009","27.177","0.003","15.627","0.0012","90","","95.929","0.007","90","","5278.6","0.8","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H78 N6 Si4 Sn -","- C48 H78 N6 Si4 Sn -","- C192 H312 N24 Si16 Sn4 -","4","1","","Chlupatý, Tomáš; Padělková, Zdeňka; DeProft, Frank; Willem, Rudolph; Růžička, Aleš","Addition of Lappert's Stannylenes to Carbodiimides, Providing a New Class of Tin(II) Guanidinates","Organometallics","2012","31","6","2203","","10.1021/om201118m","","","0.71073","MoKα","","0.0679","0.0423","","","0.0736","0.084","","","","","","1.126","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076370","12.801","0.0006","24.437","0.0012","14.0419","0.0007","90","","90.936","0.003","90","","4392","0.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H42 Cl P3 Sn -","- C54 H42 Cl P3 Sn -","- C216 H168 Cl4 P12 Sn4 -","4","1","","Kameo, Hajime; Ishii, Sho; Nakazawa, Hiroshi","Synthesis and Reactivity of Rhodium Complexes Bearing [E(o-C6H4PPh2)3]-Type Tetradentate Ligands (E = Si, Ge, and Sn)","Organometallics","2012","31","6","2212","","10.1021/om2011276","","","0.7107","MoKα","","0.0579","0.0526","","","0.1224","0.1251","","","","","","1.194","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076371","16.49","0.0005","31.31","0.001","17.71","0.0005","90","","90","","90","","9143.7","0.5","200","2","200","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C55.5 H43 Cl O P3 Rh Si -","- C55.5 H43 Cl O P3 Rh Si -","- C444 H344 Cl8 O8 P24 Rh8 Si8 -","8","1","","Kameo, Hajime; Ishii, Sho; Nakazawa, Hiroshi","Synthesis and Reactivity of Rhodium Complexes Bearing [E(o-C6H4PPh2)3]-Type Tetradentate Ligands (E = Si, Ge, and Sn)","Organometallics","2012","31","6","2212","","10.1021/om2011276","","","0.7107","MoKα","","0.0458","0.0433","","","0.084","0.085","","","","","","1.161","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076372","13.0174","0.0016","17.5299","0.0019","19.907","0.003","90","","98.82","0.003","90","","4488.9","1","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H42 Ge O P3 Rh -","- C55 H42 Ge O P3 Rh -","- C220 H168 Ge4 O4 P12 Rh4 -","4","1","","Kameo, Hajime; Ishii, Sho; Nakazawa, Hiroshi","Synthesis and Reactivity of Rhodium Complexes Bearing [E(o-C6H4PPh2)3]-Type Tetradentate Ligands (E = Si, Ge, and Sn)","Organometallics","2012","31","6","2212","","10.1021/om2011276","","","0.7107","MoKα","","0.0814","0.0644","","","0.0951","0.0991","","","","","","1.251","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076373","9.851","0.002","13.47","0.004","18.726","0.005","89.478","0.006","87.248","0.006","75.785","0.005","2405.9","1.1","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H44 Cl2 O P3 Rh Sn -","- C56 H44 Cl2 O P3 Rh Sn -","- C112 H88 Cl4 O2 P6 Rh2 Sn2 -","2","1","","Kameo, Hajime; Ishii, Sho; Nakazawa, Hiroshi","Synthesis and Reactivity of Rhodium Complexes Bearing [E(o-C6H4PPh2)3]-Type Tetradentate Ligands (E = Si, Ge, and Sn)","Organometallics","2012","31","6","2212","","10.1021/om2011276","","","0.7107","MoKα","","0.0773","0.0616","","","0.1345","0.142","","","","","","1.12","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076374","24.2964","0.0009","24.2266","0.0007","39.8765","0.0016","90","","106.537","0.0015","90","","22501.2","1.4","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C63.75 H60.5 Ge O3 P4 Rh -","- C63.75 H51 Ge O3 P4 Rh -","- C1020 H816 Ge16 O48 P64 Rh16 -","16","2","","Kameo, Hajime; Ishii, Sho; Nakazawa, Hiroshi","Synthesis and Reactivity of Rhodium Complexes Bearing [E(o-C6H4PPh2)3]-Type Tetradentate Ligands (E = Si, Ge, and Sn)","Organometallics","2012","31","6","2212","","10.1021/om2011276","","","0.7107","MoKα","","0.0695","0.0629","","","0.1385","0.1415","","","","","","1.232","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4076375","12.9502","0.0005","11.6282","0.0004","15.9231","0.0006","90","","105.476","0.002","90","","2310.88","0.15","253","2","253","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H41 Co N P3 -","- C17 H41 Co N P3 -","- C68 H164 Co4 N4 P12 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0816","0.0617","","","0.1683","0.1845","","","","","","1.055","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076376","8.9084","0.0006","13.487","0.001","20.1294","0.0014","90","","92.407","0.003","90","","2416.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H41 Co N O3 P3 -","- C17 H41 Co N O3 P3 -","- C68 H164 Co4 N4 O12 P12 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0374","0.0267","","","0.0661","0.0717","","","","","","1.045","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076377","8.1849","0.0007","9.6528","0.0008","25.202","0.002","90","","95.097","0.004","90","","1983.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H32 Co N O P2 -","- C15 H32 Co N O P2 -","- C60 H128 Co4 N4 O4 P8 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0381","0.0291","","","0.0701","0.0751","","","","","","1.022","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076378","16.8708","0.0016","10.761","0.001","16.1695","0.0015","90","","109.678","0.005","90","","2764.1","0.5","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H42 Co F3 N O3 P3 S -","- C18 H42 Co F3 N O3 P3 S -","- C72 H168 Co4 F12 N4 O12 P12 S4 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0324","0.0232","","","0.0515","0.0558","","","","","","1.054","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076379","18.8272","0.0015","16.3686","0.0013","15.3104","0.0013","90","","90","","90","","4718.3","0.7","100","2","100","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C16 H33 Co F3 N O4 P2 S -","- C16 H33 Co F3 N O4 P2 S -","- C128 H264 Co8 F24 N8 O32 P16 S8 -","8","2","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0666","0.0616","","","0.164","0.1705","","","","","","1.029","","","","has coordinates,has disorder","178652","2020-10-21","18:00:00",""
"4076380","10.6746","0.0007","19.3537","0.0013","17.1144","0.0011","90","","90.133","0.004","90","","3535.7","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H53 Co F3 O13 P5 S -","- C20 H53 Co F3 O13 P5 S -","- C80 H212 Co4 F12 O52 P20 S4 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl–Cobalt–Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0577","0.0387","","","0.0853","0.0938","","","","","","1.107","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076381","15.2319","0.0016","11.8561","0.0012","20.623","0.002","90","","97.346","0.005","90","","3693.8","0.6","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H49 Co F6 N O10 P3 S2 -","- C22 H49 Co F6 N O10 P3 S2 -","- C88 H196 Co4 F24 N4 O40 P12 S8 -","4","1","","Bleeke, John R.; Anutrasakda, Wipark; Rath, Nigam P.","Synthesis, Structure, Spectroscopy, and Reactivity of Azapentadienyl‒Cobalt‒Phosphine Complexes(1)","Organometallics","2012","31","6","2219","","10.1021/om2011326","","","0.71073","MoKα","","0.0425","0.03","","","0.0631","0.0697","","","","","","1.045","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076382","10.758","0.004","16.535","0.005","21.784","0.007","68.108","0.005","82.948","0.005","76.449","0.004","3493","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H50 B20 Co N4 -","- C18 H50 B20 Co N4 -","- C72 H200 B80 Co4 N16 -","4","2","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.1114","0.0499","","","0.0997","0.1146","","","","","","0.805","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076383","14.7384","0.0015","13.0987","0.0013","19.264","0.002","90","","108.937","0.002","90","","3517.7","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H50 B20 N4 Ni -","- C18 H50 B20 N4 Ni -","- C72 H200 B80 N16 Ni4 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.1038","0.0463","","","0.1194","0.1546","","","","","","0.834","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076384","21.703","0.007","12.238","0.004","19.483","0.007","90","","90","","90","","5175","3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C30 H66 B20 N4 Ni -","- C30 H66 B20 N4 Ni -","- C120 H264 B80 N16 Ni4 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.0973","0.0594","","","0.1461","0.1556","","","","","","0.882","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076385","13.682","0.009","8.324","0.005","15.107","0.01","90","","101.544","0.009","90","","1685.7","1.9","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C18 H50 B20 Cu N4 -","- C18 H50 B20 Cu N4 -","- C36 H100 B40 Cu2 N8 -","2","0.5","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.116","0.0763","","","0.1709","0.182","","","","","","0.912","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076386","10.419","0.004","17.301","0.007","10.917","0.004","90","","109.029","0.005","90","","1860.4","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H25 B10 Cu N2 S -","- C9 H25 B10 Cu N2 S -","- C36 H100 B40 Cu4 N8 S4 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.1087","0.0417","","","0.0638","0.0733","","","","","","0.745","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076387","9.19","0.004","12.995","0.005","13.616","0.005","90","","90","","90","","1626.1","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H27 B9 N2 -","- C9 H27 B9 N2 -","- C36 H108 B36 N8 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.0723","0.0622","","","0.1597","0.1662","","","","","","1.026","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076388","9.343","0.005","11.937","0.006","19.679","0.01","90","","101.363","0.007","90","","2151.7","1.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H35 B9 N2 -","- C15 H35 B9 N2 -","- C60 H140 B36 N8 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.1198","0.0583","","","0.1254","0.146","","","","","","0.856","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076389","9.531","0.003","18.238","0.006","19.183","0.007","90","","103.276","0.004","90","","3245.4","1.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H41 B9 Cl N2 Ni P -","- C27 H41 B9 Cl N2 Ni P -","- C108 H164 B36 Cl4 N8 Ni4 P4 -","4","1","","Yao, Zi-Jian; Jin, Guo-Xin","Synthesis, Reactivity, and Structural Transformation of Mono- and Binuclear Carboranylamidinate-Based 3d Metal Complexes and Metallacarborane Derivatives","Organometallics","2012","31","5","1767","","10.1021/om2011358","","","0.71073","MoKα","","0.0816","0.0489","","","0.1093","0.1195","","","","","","0.876","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076390","13.4","0.003","15.493","0.002","14.738","0.002","90","","110.416","0.012","90","","2867.5","0.9","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19.5 H33 Cl2 O2.5 Si4 Zr -","- C18 H30 Cl2 O2 Si4 Zr -","- C72 H120 Cl8 O8 Si16 Zr4 -","4","1","","Londaitsbehere, Addis; Cuenca, Tomás; Mosquera, Marta E.G.; Cano, Jesús; Milione, Stefano; Grassi, Alfonso","1,3-Double Siloxo-Bridged Zirconium Metallocene for Propene and 1-Hexene Regioselective Oligomerization","Organometallics","2012","31","5","2108","","10.1021/om2011535","","","0.71069","MoKα","","0.1293","0.0608","","","0.1415","0.1613","","","","","","0.99","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076391","8.3961","0.0004","24.1322","0.0015","9.1451","0.0005","90","","111.076","0.002","90","","1728.99","0.17","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C15 H23 N2 O2 P W -","- C15 H23 N2 O2 P W -","- C60 H92 N8 O8 P4 W4 -","4","1","","van der Eide, Edwin F.; Liu, Tianbiao; Camaioni, Donald M.; Walter, Eric D.; Bullock, R. Morris","Facile Thermal W‒W Bond Homolysis in the N-Heterocyclic Carbene Containing Tungsten Dimer [CpW(CO)2(IMe)]2","Organometallics","2012","31","5","1775","","10.1021/om201162g","","","0.71073","MoKα","","0.0121","0.012","","","0.0277","0.0278","","","","","","1","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076392","18.4009","0.0009","13.5082","0.0007","13.939","0.0013","90","","120.862","0.002","90","","2974.1","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15.5 H18 N2 O2 W -","- C15.5 H18 N2 O2 W -","- C124 H144 N16 O16 W8 -","8","1","","van der Eide, Edwin F.; Liu, Tianbiao; Camaioni, Donald M.; Walter, Eric D.; Bullock, R. Morris","Facile Thermal W–W Bond Homolysis in the N-Heterocyclic Carbene Containing Tungsten Dimer [CpW(CO)2(IMe)]2","Organometallics","2012","31","5","1775","","10.1021/om201162g","","","0.71073","MoKα","","0.0203","0.0172","","","0.0366","0.0381","","","","","","1.083","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076393","10.5707","0.0003","12.0465","0.0003","14.5973","0.0004","90","","104.596","0.001","90","","1798.83","0.08","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 F6 N3 O2 P W -","- C14 H16 F6 N3 O2 P W -","- C56 H64 F24 N12 O8 P4 W4 -","4","1","","van der Eide, Edwin F.; Liu, Tianbiao; Camaioni, Donald M.; Walter, Eric D.; Bullock, R. Morris","Facile Thermal W‒W Bond Homolysis in the N-Heterocyclic Carbene Containing Tungsten Dimer [CpW(CO)2(IMe)]2","Organometallics","2012","31","5","1775","","10.1021/om201162g","","","0.71073","MoKα","","0.0156","0.0146","","","0.0719","0.0756","","","","","","0.698","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076394","7.63","0.0003","11.6244","0.0006","22.3412","0.001","90","","91.084","0.002","90","","1981.18","0.16","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 F6 N2 O3 P W -","- C16 H21 F6 N2 O3 P W -","- C64 H84 F24 N8 O12 P4 W4 -","4","1","","van der Eide, Edwin F.; Liu, Tianbiao; Camaioni, Donald M.; Walter, Eric D.; Bullock, R. Morris","Facile Thermal W‒W Bond Homolysis in the N-Heterocyclic Carbene Containing Tungsten Dimer [CpW(CO)2(IMe)]2","Organometallics","2012","31","5","1775","","10.1021/om201162g","","","0.71073","MoKα","","0.0459","0.0442","","","0.1249","0.1267","","","","","","0.969","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076395","9.972","0.0006","19.5503","0.001","10.5346","0.0006","90","","114.459","0.003","90","","1869.47","0.19","230","2","230","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H59 Lu N4 O Si2 -","- C33 H59 Lu N4 O Si2 -","- C66 H118 Lu2 N8 O2 Si4 -","2","1","","Otero, Antonio; Lara-Sánchez, Agustín; Nájera, Carmen; Fernández-Baeza, Juan; Márquez-Segovia, Isabel; Castro-Osma, José Antonio; Martínez, Javier; Sánchez-Barba, Luis F.; Rodríguez, Ana M.","New Highly Active Heteroscorpionate-Containing Lutetium Catalysts for the Hydroamination of Aminoalkenes: Isolation and Structural Characterization of a Dipyrrolidinide–Lutetium Complex","Organometallics","2012","31","6","2244","","10.1021/om2011672","","","0.71073","MoKα","","0.0757","0.0637","","","0.1498","0.1572","","","","","","1.057","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076396","15.199","0.002","25.257","0.003","15.9042","0.0019","90","","94.575","0.007","90","","6085.9","1.3","230","2","230","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72.5 H85 Lu N6 -","- C55 H65 Lu N6 -","- C220 H260 Lu4 N24 -","4","1","","Otero, Antonio; Lara-Sánchez, Agustín; Nájera, Carmen; Fernández-Baeza, Juan; Márquez-Segovia, Isabel; Castro-Osma, José Antonio; Martínez, Javier; Sánchez-Barba, Luis F.; Rodríguez, Ana M.","New Highly Active Heteroscorpionate-Containing Lutetium Catalysts for the Hydroamination of Aminoalkenes: Isolation and Structural Characterization of a Dipyrrolidinide‒Lutetium Complex","Organometallics","2012","31","6","2244","","10.1021/om2011672","","","0.71073","MoKα","","0.117","0.0457","","","0.1228","0.156","","","","","","0.859","","","","has coordinates","178652","2020-10-21","18:00:00",""
"4076397","10.842","0.0004","22.6464","0.0007","14.5229","0.0005","90","","98.322","0.002","90","","3528.3","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H102 N4 Ni2 O2 -","- C82 H102 N4 Ni2 O2 -","- C164 H204 N8 Ni4 O4 -","2","0.5","","Radlauer, Madalyn; Day, Michael W.; Agapie, Theodor","Dinickel Bisphenoxyiminato Complexes for the Polymerization of Ethylene and α-Olefins.","Organometallics","2012","31","6","2231","2243","10.1021/om2011694","","","0.71073","MoKα","","0.0909","0.0628","","","0.0754","0.0759","","","","","","3.87","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4076398","17.1455","0.001","18.0109","0.001","23.4009","0.0013","70.258","0.003","72.094","0.003","84.191","0.003","6472.1","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C70.5 H92 N4 Ni2 O2 -","- C70.5 H92 N4 Ni2 O2 -","- C282 H368 N16 Ni8 O8 -","4","2","","Radlauer, Madalyn; Day, Michael W.; Agapie, Theodor","Dinickel Bisphenoxyiminato Complexes for the Polymerization of Ethylene and α-Olefins.","Organometallics","2012","31","6","2231","2243","10.1021/om2011694","","","0.71073","MoKα","","0.1363","0.0558","","","0.0618","0.0655","","","","","","1.277","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4076399","9.3525","0.0004","13.3346","0.0006","16.0237","0.0007","69.653","0.002","77.243","0.002","87.569","0.002","1826.12","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H45 B N5 Rh -","- C45 H45 B N5 Rh -","- C90 H90 B2 N10 Rh2 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl–1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0395","0.0296","","","0.0632","0.067","","","","","","1.028","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076400","13.4051","0.0009","14.1548","0.001","15.0838","0.0009","85.584","0.002","81.196","0.002","69.99","0.002","2656.7","0.3","155","2","155","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H37 B F24 N5 Rh -","- C53 H37 B F24 N5 Rh -","- C106 H74 B2 F48 N10 Rh2 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl–1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0473","0.039","","","0.0963","0.1029","","","","","","1.036","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076401","9.3735","0.0004","13.3351","0.0006","16.0351","0.0007","69.528","0.002","77.209","0.002","87.864","0.002","1829.38","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H45 B Ir N5 -","- C45 H45 B Ir N5 -","- C90 H90 B2 Ir2 N10 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl–1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0218","0.0185","","","0.0413","0.0422","","","","","","1.162","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076402","14.0676","0.0005","12.4987","0.0004","21.4061","0.0007","90","","90","","90","","3763.8","0.2","155","2","155","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 B Cl2 N5 O2 Rh -","- C40 H35 B Cl2 N5 O2 Rh -","- C160 H140 B4 Cl8 N20 O8 Rh4 -","4","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl‒1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0387","0.0284","","","0.0694","0.0719","","","","","","1.034","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076403","14.0962","0.0006","12.5037","0.0005","21.2816","0.0009","90","","90","","90","","3751","0.3","151","2","151","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H35 B Cl2 Ir N5 O2 -","- C40 H35 B Cl2 Ir N5 O2 -","- C160 H140 B4 Cl8 Ir4 N20 O8 -","4","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl‒1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0534","0.0267","","","0.0424","0.0468","","","","","","0.642","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076404","12.5688","0.001","13.8752","0.0011","15.9496","0.0013","92.637","0.003","108.229","0.002","105.087","0.003","2526.1","0.4","155","2","155","2","","","","","","","","8","P -1","-P 1","2","","","","- C47.5 H25 B Cl F24 Ir N5 O2 -","- C47.25 H25 B Cl0.52 F24 Ir N5 O2 -","- C94.5 H50 B2 Cl1.04 F48 Ir2 N10 O4 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl‒1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0469","0.0432","","","0.1352","0.1392","","","","","","0.998","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4076405","12.9385","0.0006","13.453","0.0007","16.1153","0.0008","96.722","0.002","109.539","0.002","100.642","0.002","2549.2","0.2","151","2","151","2","","","","","","","","8","P -1","-P 1","2","","","","- C47 H25 B Cl2 F24 N5 O2 Rh -","- C47 H25 B Cl2 F24 N5 O2 Rh -","- C94 H50 B2 Cl4 F48 N10 O4 Rh2 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl‒1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0417","0.0379","","","0.1248","0.1313","","","","","","1.091","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076406","12.984","0.003","13.44","0.003","16.087","0.004","96.593","0.004","109.454","0.004","100.85","0.004","2551.5","1","151","2","151","2","","","","","","","","8","P -1","-P 1","2","","","","- C47 H25 B Cl2 F24 Ir N5 O2 -","- C47 H25 B Cl2 F24 Ir N5 O2 -","- C94 H50 B2 Cl4 F48 Ir2 N10 O4 -","2","1","","Hua, Carol; Vuong, Khuong Q.; Bhadbhade, Mohan; Messerle, Barbara A.","New Rhodium(I) and Iridium(I) Complexes Containing Mixed Pyrazolyl‒1,2,3-Triazolyl Ligands As Catalysts for Hydroamination","Organometallics","2012","31","5","1790","","10.1021/om201171b","","","0.71073","MoKα","","0.0261","0.0245","","","0.0624","0.0641","","","","","","1.057","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076407","7.7013","0.0014","12.887","0.002","15.119","0.003","70.48","0.008","75.639","0.009","75.383","0.009","1346.3","0.4","222","2","222","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H28 Cl N6 O3 Pt S4 -","- C17 H29 Cl N6 O3 Pt S4 -","- C34 H58 Cl2 N12 O6 Pt2 S8 -","2","1","","Ali, Awadelkareem A.; Nimir, Hassan; Aktas, Cenk; Huch, Volker; Rauch, Ulrich; Schäfer, Karl-Herbert; Veith, Michael","Organoplatinum(II) Complexes with 2-Acetylthiophene Thiosemicarbazone: Synthesis, Characterization, Crystal Structures, and in Vitro Antitumor Activity","Organometallics","2012","31","6","2256","","10.1021/om201178q","","","0.71073","MoKα","","0.0835","0.0744","","","0.2018","0.2082","","","","","","1.147","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076408","9.7853","0.0015","11.775","0.0018","24.179","0.004","96.994","0.006","93.403","0.007","94.925","0.006","2748.1","0.8","134","2","134","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H56 N16 O4 Pt4 S8 -","- C40 H56 N16 O4 Pt4 S8 -","- C80 H112 N32 O8 Pt8 S16 -","2","1","","Ali, Awadelkareem A.; Nimir, Hassan; Aktas, Cenk; Huch, Volker; Rauch, Ulrich; Schäfer, Karl-Herbert; Veith, Michael","Organoplatinum(II) Complexes with 2-Acetylthiophene Thiosemicarbazone: Synthesis, Characterization, Crystal Structures, and in Vitro Antitumor Activity","Organometallics","2012","31","6","2256","","10.1021/om201178q","","","0.71073","MoKα","","0.1269","0.0665","","","0.1253","0.1454","","","","","","1.041","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076409","9.3774","0.0002","19.0852","0.0003","10.0191","0.0002","90","","94.8205","0.0013","90","","1786.77","0.06","200","","200","","","","","","","","local","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H6 As4 I6 -","- C3 H6 As4 I6 -","- C12 H24 As16 I24 -","4","1","","Lu, Di; Coote, Michelle L.; Ho, Junming; Kilah, Nathan L.; Lin, Ching-Yeh; Salem, Geoff; Weir, Michelle L.; Willis, Anthony C.; Wild, S. Bruce; Dilda, Pierre J.","Resolution and Improved Synthesis of (±)-Arsenicin A: A Natural Adamantane-Type Tetraarsenical Possessing Strong Anti-Acute Promelocytic Leukemia Cell Line Activity","Organometallics","2012","31","5","1808","","10.1021/om201180d","","","0.71073","MoKα","","0.0376","0.0318","","0.0831","0.078","0.0831","","","","","","0.9534","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076410","6.8594","0.0003","9.8038","0.0005","12.3203","0.0006","90","","90","","90","","828.52","0.07","150","","150","","","","","","","","local","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H6 As4 O3 -","- C3 H6 As4 O3 -","- C12 H24 As16 O12 -","4","1","","Lu, Di; Coote, Michelle L.; Ho, Junming; Kilah, Nathan L.; Lin, Ching-Yeh; Salem, Geoff; Weir, Michelle L.; Willis, Anthony C.; Wild, S. Bruce; Dilda, Pierre J.","Resolution and Improved Synthesis of (±)-Arsenicin A: A Natural Adamantane-Type Tetraarsenical Possessing Strong Anti-Acute Promelocytic Leukemia Cell Line Activity","Organometallics","2012","31","5","1808","","10.1021/om201180d","","","0.71073","MoKα","","0.0414","0.0355","","0.0835","0.0804","0.0835","","","","","","1.0708","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076411","19.0109","0.0004","19.2536","0.0005","21.9965","0.0006","90","","98.13","0.003","90","","7970.4","0.3","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H54 Cl2 P3 Re -","- C38 H54 Cl2 P3 Re -","- C304 H432 Cl16 P24 Re8 -","8","2","","Chen, Jiangxi; Shi, Chuan; Sung, Herman Ho-Yung; Williams, Ian Duncan; Lin, Zhenyang; Jia, Guochen","Hydrogen Shift Reactions of Rhenium Hydrido Carbyne Complexes","Organometallics","2012","31","5","1817","","10.1021/om201184m","","x-ray","1.5418","CuKα","","0.0272","0.0227","","","0.0527","0.0538","","","","","","1.024","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076412","9.7693","0.0001","10.0002","0.0001","38.8107","0.0004","90","","95.089","0.001","90","","3776.66","0.07","143","","143","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H55 Cl P3 Re -","- C38 H55 Cl P3 Re -","- C152 H220 Cl4 P12 Re4 -","4","1","","Chen, Jiangxi; Shi, Chuan; Sung, Herman Ho-Yung; Williams, Ian Duncan; Lin, Zhenyang; Jia, Guochen","Hydrogen Shift Reactions of Rhenium Hydrido Carbyne Complexes","Organometallics","2012","31","5","1817","","10.1021/om201184m","","","1.5418","CuKα","","0.0497","0.0372","","","0.0786","0.0822","","","","","","1.013","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076413","22.908","0.007","22.9","0.006","15.363","0.006","90","","127.463","0.017","90","","6397","4","233","2","233","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H53 B Ru3 -","- C34 H51 B Ru3 -","- C272 H408 B8 Ru24 -","8","1","","Takao, Toshiro; Suwa, Hitoshi; Okamura, Rei; Suzuki, Hiroharu","Formation of a Boraruthenacyclopentenyl Skeleton via B‒C Bond Formation across a Triruthenium Plane","Organometallics","2012","31","5","1825","","10.1021/om201186z","","","0.71069","MoKα","","0.0392","0.0272","","","0.0697","0.0745","","","","","","1.038","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076414","11.1524","0.0008","11.6756","0.0009","15.788","0.0011","100.748","0.002","90.607","0.002","113.712","0.0019","1840.8","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H57 B Ru3 -","- C40 H57 B Ru3 -","- C80 H114 B2 Ru6 -","2","1","","Takao, Toshiro; Suwa, Hitoshi; Okamura, Rei; Suzuki, Hiroharu","Formation of a Boraruthenacyclopentenyl Skeleton via B‒C Bond Formation across a Triruthenium Plane","Organometallics","2012","31","5","1825","","10.1021/om201186z","","","0.71069","MoKα","","0.0495","0.037","","","0.0856","0.0929","","","","","","1.068","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076415","18.2835","0.0003","22.4887","0.0004","15.8839","0.0003","90","","90","","90","","6531","0.2","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C34 H53 B Ru3 -","- C34 H46 B Ru3 -","- C272 H368 B8 Ru24 -","8","1","","Takao, Toshiro; Suwa, Hitoshi; Okamura, Rei; Suzuki, Hiroharu","Formation of a Boraruthenacyclopentenyl Skeleton via B–C Bond Formation across a Triruthenium Plane","Organometallics","2012","31","5","1825","","10.1021/om201186z","","","0.71069","MoKα","","0.0458","0.0432","","","0.0967","0.0979","","","","","","1.21","","","","has coordinates","288539","2023-12-24","00:56:18",""
"4076416","9.0774","0.0002","22.2969","0.0005","10.8304","0.0003","90","","104.302","0.003","90","","2124.11","0.09","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 N O P Re -","- C24 H25 N O P Re -","- C96 H100 N4 O4 P4 Re4 -","4","1","","Dudle, Balz; Blacque, Olivier; Berke, Heinz","Ethylene Reactions of a [ReH(η2-BH4)(NO)(PPh3)2] Complex: Reductive Elimination of Ethane and Oxidative Coupling to Butadiene","Organometallics","2012","31","5","1832","","10.1021/om201187w","","","0.71073","MoKα","","0.029","0.0254","","","0.057","0.0579","","","","","","1.242","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076417","12.8813","0.001","16.6456","0.0013","32.319","0.002","90","","90","","90","","6929.7","0.9","230","2","230","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C35 H51 N4 Nb -","- C35 H51 N4 Nb -","- C280 H408 N32 Nb8 -","8","1","","Elorriaga, David; Carrillo-Hermosilla, Fernando; Antiñolo, Antonio; López-Solera, Isabel; Menot, Bérengère; Fernández-Galán, Rafael; Villaseñor, Elena; Otero, Antonio","New Alkylimido Niobium Complexes Supported by Guanidinate Ligands: Synthesis, Characterization, and Migratory Insertion Reactions","Organometallics","2012","31","5","1840","","10.1021/om201192w","","","0.71073","MoKα","","0.1506","0.0615","","","0.1211","0.1496","","","","","","0.977","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076418","8.4533","0.0005","12.2229","0.0006","16.9605","0.0012","104.483","0.005","97.859","0.005","108.605","0.003","1562.66","0.18","230","2","230","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H45 N4 Nb O -","- C32 H45 N4 Nb O -","- C64 H90 N8 Nb2 O2 -","2","1","","Elorriaga, David; Carrillo-Hermosilla, Fernando; Antiñolo, Antonio; López-Solera, Isabel; Menot, Bérengère; Fernández-Galán, Rafael; Villaseñor, Elena; Otero, Antonio","New Alkylimido Niobium Complexes Supported by Guanidinate Ligands: Synthesis, Characterization, and Migratory Insertion Reactions","Organometallics","2012","31","5","1840","","10.1021/om201192w","","","0.71073","MoKα","","0.1958","0.0696","","","0.1099","0.1513","","","","","","0.883","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076419","29.609","0.003","15.5693","0.0014","16.6469","0.0015","90","","121.992","0.002","90","","6508.6","1.1","230","2","230","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64 H96 N8 Nb2 O2 -","- C64 H96 N8 Nb2 O2 -","- C256 H384 N32 Nb8 O8 -","4","0.5","","Elorriaga, David; Carrillo-Hermosilla, Fernando; Antiñolo, Antonio; López-Solera, Isabel; Menot, Bérengère; Fernández-Galán, Rafael; Villaseñor, Elena; Otero, Antonio","New Alkylimido Niobium Complexes Supported by Guanidinate Ligands: Synthesis, Characterization, and Migratory Insertion Reactions","Organometallics","2012","31","5","1840","","10.1021/om201192w","","","0.71073","MoKα","","0.204","0.0787","","","0.1447","0.1936","","","","","","0.922","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076420","13.083","0.007","22.92","0.012","33.053","0.017","90","","90","","90","","9911","9","230","2","230","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C102 H140 N12 Nb2 -","- C102 H140 N12 Nb2 -","- C408 H560 N48 Nb8 -","4","1","","Elorriaga, David; Carrillo-Hermosilla, Fernando; Antiñolo, Antonio; López-Solera, Isabel; Menot, Bérengère; Fernández-Galán, Rafael; Villaseñor, Elena; Otero, Antonio","New Alkylimido Niobium Complexes Supported by Guanidinate Ligands: Synthesis, Characterization, and Migratory Insertion Reactions","Organometallics","2012","31","5","1840","","10.1021/om201192w","","","0.71073","MoKα","","0.2854","0.0956","","","0.1639","0.2287","","","","","","0.921","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076421","12.043","0.008","10.885","0.009","21.822","0.019","90","","101.511","0.018","90","","2803","4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 N O3 Ta -","- C26 H30 N O3 Ta -","- C104 H120 N4 O12 Ta4 -","4","1","","Fandos, Rosa; Otero, Antonio; Rodríguez, Ana M.; Suizo, Sara","Tantalum Complexes Supported by Asymmetric [ONO] Ligands. The Role of Weakly Coordinating Anions on Their Reactivity","Organometallics","2012","31","5","1849","","10.1021/om201199p","","","0.71073","MoKα","","0.0631","0.0439","","","0.1155","0.125","","","","","","0.93","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076422","20.483","0.004","14.542","0.002","18.93","0.005","90","","90","","90","","5639","2","230","2","230","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C26 H27 F3 N O6 S Ta -","- C26 H27 F3 N O6 S Ta -","- C208 H216 F24 N8 O48 S8 Ta8 -","8","1","","Fandos, Rosa; Otero, Antonio; Rodríguez, Ana M.; Suizo, Sara","Tantalum Complexes Supported by Asymmetric [ONO] Ligands. The Role of Weakly Coordinating Anions on Their Reactivity","Organometallics","2012","31","5","1849","","10.1021/om201199p","","","0.71073","MoKα","","0.1148","0.0567","","","0.1268","0.1466","","","","","","0.869","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076423","9.752","0.005","12.598","0.006","16.062","0.008","71.264","0.01","82.311","0.012","69.52","0.011","1750.1","1.5","230","2","230","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H38 F3 N2 O7 S Ta -","- C31 H38 F3 N2 O7 S Ta -","- C62 H76 F6 N4 O14 S2 Ta2 -","2","1","","Fandos, Rosa; Otero, Antonio; Rodríguez, Ana M.; Suizo, Sara","Tantalum Complexes Supported by Asymmetric [ONO] Ligands. The Role of Weakly Coordinating Anions on Their Reactivity","Organometallics","2012","31","5","1849","","10.1021/om201199p","","","0.71073","MoKα","","0.0383","0.0327","","","0.0766","0.0803","","","","","","1.052","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076424","15.959","0.008","13.032","0.006","13.592","0.01","90","","122.39","0.011","90","","2387","2","230","2","230","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H9 B F N O3 -","- C14 H9 B F N O3 -","- C112 H72 B8 F8 N8 O24 -","8","1","","Fandos, Rosa; Otero, Antonio; Rodríguez, Ana M.; Suizo, Sara","Tantalum Complexes Supported by Asymmetric [ONO] Ligands. The Role of Weakly Coordinating Anions on Their Reactivity","Organometallics","2012","31","5","1849","","10.1021/om201199p","","","0.71073","MoKα","","0.2482","0.0641","","","0.1006","0.1499","","","","","","0.908","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076425","34.714","0.003","17.3092","0.0014","20.5712","0.0017","90","","96.598","0.002","90","","12278.8","1.8","193","2","193","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C62.5 H59 Cl F3 Ir O8 P4 Ru S -","- C58 H48 F3 Ir O7 P4 Ru S -","- C464 H384 F24 Ir8 O56 P32 Ru8 S8 -","8","1","","MacDougall, Tiffany J.; Samant, Rahul G.; Trepanier, Steven J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Geminal Carbon‒Hydrogen Bond Activation in Cumulenes Promoted by Adjacent Iridium/Ruthenium Centers","Organometallics","2012","31","5","1857","","10.1021/om201201h","","","0.71073","MoKα","","0.0669","0.0416","","","0.1005","0.1103","","","","","","1.003","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076426","18.5564","0.0013","15.2146","0.001","24.4022","0.0016","90","","90","","90","","6889.4","0.8","173","2","173","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C74 H78 F3 Ir O10.5 P4 Ru S -","- C60 H50 F3 Ir O7 P4 Ru S -","- C240 H200 F12 Ir4 O28 P16 Ru4 S4 -","4","0.5","","MacDougall, Tiffany J.; Samant, Rahul G.; Trepanier, Steven J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Geminal Carbon‒Hydrogen Bond Activation in Cumulenes Promoted by Adjacent Iridium/Ruthenium Centers","Organometallics","2012","31","5","1857","","10.1021/om201201h","","","0.71073","MoKα","","0.0664","0.0608","","","0.1354","0.1379","","","","","","1.131","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4076427","17.5797","0.0011","23.6325","0.0015","26.428","0.0017","90","","95.2753","0.0009","90","","10933.1","1.2","193","2","193","2","","","","","","","","9","I 1 2/a 1","-I 2ya","15","","","","- C57.5 H47 Cl F3 Ir O7 P4 Ru S -","- C57.5 H47 Cl F3 Ir O7 P4 Ru S -","- C460 H376 Cl8 F24 Ir8 O56 P32 Ru8 S8 -","8","1","","MacDougall, Tiffany J.; Samant, Rahul G.; Trepanier, Steven J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Geminal Carbon‒Hydrogen Bond Activation in Cumulenes Promoted by Adjacent Iridium/Ruthenium Centers","Organometallics","2012","31","5","1857","","10.1021/om201201h","","","0.71073","MoKα","","0.0439","0.0303","","","0.0771","0.0911","","","","","","1.122","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076428","12.247","0.005","18.471","0.005","18.353","0.005","90","","103.398","0.005","90","","4039","2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2a","","","- C42 H58 Ca N4 O2 -","- C42 H58 Ca N4 O2 -","- C168 H232 Ca4 N16 O8 -","4","1","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.1118","0.0709","","","0.1493","0.1787","","","","","","1.073","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076429","9.464","0.005","12.651","0.005","13.61","0.005","91.323","0.005","93.428","0.005","104.213","0.005","1575.6","1.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","2b","","","- C34 H42 Ca N4 O2 -","- C34 H42 Ca N4 O2 -","- C68 H84 Ca2 N8 O4 -","2","1","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.1707","0.08","","","0.1711","0.2305","","","","","","1.026","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076430","10.6913","0.0009","15.342","0.0011","22.2988","0.0017","90","","96.069","0.004","90","","3637.1","0.5","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","4a","","","- C31 H55 Ca N3 O2 Si2 -","- C31 H55 Ca N3 O2 Si2 -","- C124 H220 Ca4 N12 O8 Si8 -","4","1","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71075","MoKα","","0.1008","0.0625","","","0.1303","0.1503","","","","","","1.061","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076431","10.69","0.005","10.69","0.005","38.51","0.005","90","","90","","90","","4401","3","120","2","120","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","5a","","","- C46 H66 N4 O3 Sr -","- C46 H66 N4 O3 Sr -","- C184 H264 N16 O12 Sr4 -","4","0.5","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.0718","0.0552","","","0.0904","0.0955","","","","","","1.037","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076432","10.708","0.005","10.708","0.005","39.197","0.005","90","","90","","90","","4494","3","120","2","120","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","6a","","","- C46 H66 Ba N4 O3 -","- C46 H66 Ba N4 O3 -","- C184 H264 Ba4 N16 O12 -","4","0.5","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.0865","0.0689","","","0.1076","0.1136","","","","","","1.016","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076433","11.676","0.005","21.378","0.005","17.882","0.005","90","","127.853","0.017","90","","3524","2","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","7a","","","- C38 H50 Mg N4 O -","- C38 H50 Mg N4 O -","- C152 H200 Mg4 N16 O4 -","4","1","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.1047","0.0793","","","0.1519","0.1654","","","","","","1.052","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076434","11.596","0.005","10.053","0.005","16.721","0.005","90","","127.922","0.018","90","","1537.7","1.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","7b","","","- C34 H42 Mg N4 O2 -","- C34 H42 Mg N4 O2 -","- C68 H84 Mg2 N8 O4 -","2","0.5","","Panda, Tarun K.; Yamamoto, Keishi; Yamamoto, Koji; Kaneko, Hiroshi; Yang, Yi; Tsurugi, Hayato; Mashima, Kazushi","Preparation and Structure of Iminopyrrolyl and Amidopyrrolyl Complexes of Group 2 Metals","Organometallics","2012","31","6","2268","","10.1021/om201210y","","","0.71069","MoKα","","0.059","0.0536","","","0.1463","0.1518","","","","","","1.057","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076435","12.1498","0.0003","17.4739","0.0004","18.4022","0.0005","90","","100.35","0.002","90","","3843.3","0.17","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C39 H56 Cl2 Fe N4 O -","- C39 H56 Cl2 Fe N4 O -","- C156 H224 Cl8 Fe4 N16 O4 -","4","2","","E Stieber, S Chantal; Milsmann, Carsten; Hoyt, Jordan M.; Turner, Zoë R; Finkelstein, Kenneth D.; Wieghardt, Karl; Debeer, Serena; Chirik, Paul J.","Bis(imino)pyridine Iron Dinitrogen Compounds Revisited: Differences in Electronic Structure Between Four- and Five-Coordinate Derivatives.","Organometallics","2012","31","6","2275","2285","10.1021/om201212m","","","1.54178","CuKα","","0.0408","0.0381","","","0.0941","0.0955","","","","","","1.066","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076436","20.948","0.003","17.985","0.003","21.125","0.003","90","","109.535","0.002","90","","7501","2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C72 H94 Cl4 F6 Fe2 N6 O -","- C72 H94 Cl4 F6 Fe2 N6 O -","- C288 H376 Cl16 F24 Fe8 N24 O4 -","4","1","","E Stieber, S Chantal; Milsmann, Carsten; Hoyt, Jordan M.; Turner, Zoë R; Finkelstein, Kenneth D.; Wieghardt, Karl; Debeer, Serena; Chirik, Paul J.","Bis(imino)pyridine Iron Dinitrogen Compounds Revisited: Differences in Electronic Structure Between Four- and Five-Coordinate Derivatives.","Organometallics","2012","31","6","2275","2285","10.1021/om201212m","","","0.71073","MoKα","","0.0962","0.0565","","","0.1282","0.1468","","","","","","1.053","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076437","10.5183","0.0002","17.8814","0.0003","21.2857","0.0004","90","","100.397","0.001","90","","3937.72","0.12","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H58 Fe N4 O3 -","- C41 H58 Fe N4 O3 -","- C164 H232 Fe4 N16 O12 -","4","1","","E Stieber, S Chantal; Milsmann, Carsten; Hoyt, Jordan M.; Turner, Zoë R; Finkelstein, Kenneth D.; Wieghardt, Karl; Debeer, Serena; Chirik, Paul J.","Bis(imino)pyridine Iron Dinitrogen Compounds Revisited: Differences in Electronic Structure Between Four- and Five-Coordinate Derivatives.","Organometallics","2012","31","6","2275","2285","10.1021/om201212m","","","1.54178","CuKα","","0.0374","0.0318","","","0.0747","0.0798","","","","","","0.673","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076438","12.4483","0.0001","13.0656","0.0001","24.0716","0.0003","99.752","0.001","94.988","0.001","100.861","0.001","3760.74","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H51 Fe N7 -","- C37 H51 Fe N7 -","- C148 H204 Fe4 N28 -","4","2","","E Stieber, S Chantal; Milsmann, Carsten; Hoyt, Jordan M.; Turner, Zoë R; Finkelstein, Kenneth D.; Wieghardt, Karl; Debeer, Serena; Chirik, Paul J.","Bis(imino)pyridine Iron Dinitrogen Compounds Revisited: Differences in Electronic Structure Between Four- and Five-Coordinate Derivatives.","Organometallics","2012","31","6","2275","2285","10.1021/om201212m","","","1.54178","CuKα","","0.0417","0.0358","","","0.1058","0.1143","","","","","","0.52","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076439","10.5545","0.0003","17.864","0.0005","21.5286","0.0006","90","","100.644","0.002","90","","3989.3","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H58 Fe N8 O -","- C39 H58 Fe N8 O -","- C156 H232 Fe4 N32 O4 -","4","1","","E Stieber, S Chantal; Milsmann, Carsten; Hoyt, Jordan M.; Turner, Zoë R; Finkelstein, Kenneth D.; Wieghardt, Karl; Debeer, Serena; Chirik, Paul J.","Bis(imino)pyridine Iron Dinitrogen Compounds Revisited: Differences in Electronic Structure Between Four- and Five-Coordinate Derivatives.","Organometallics","2012","31","6","2275","2285","10.1021/om201212m","","","0.71073","MoKα","","0.0733","0.0434","","","0.104","0.1232","","","","","","1.047","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076440","10.5127","0.0005","11.6941","0.0006","11.9926","0.0006","90","","103.854","0.0009","90","","1431.44","0.12","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H44 Cl2 Ir2 O2 P4 -","- C20 H44 Cl2 Ir2 O2 P4 -","- C40 H88 Cl4 Ir4 O4 P8 -","2","0.5","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C‒H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.0271","0.0265","","","0.0721","0.0725","","","","","","1.226","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076441","10.6784","0.0007","12.5837","0.0009","14.9169","0.001","111.404","0.001","96.2866","0.0011","107.84","0.0011","1720.2","0.2","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H47 F3 Ir2 O6 P4 S -","- C23 H47 F3 Ir2 O6 P4 S -","- C46 H94 F6 Ir4 O12 P8 S2 -","2","1","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C‒H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.0374","0.0308","","","0.0776","0.0811","","","","","","1.05","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076442","10.4972","0.0006","11.6908","0.0006","12.0101","0.0007","90","","103.795","0.001","90","","1431.37","0.14","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H44 Cl2 O2 P4 Rh2 -","- C20 H44 Cl2 O2 P4 Rh2 -","- C40 H88 Cl4 O4 P8 Rh4 -","2","0.5","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C‒H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.0247","0.0231","","","0.06","0.0608","","","","","","1.139","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076443","14.9379","0.0005","14.7561","0.0005","30.2835","0.0011","90","","103.427","0.0005","90","","6492.8","0.4","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C53.5 H58 B Cl F24 O3 P4 Rh2 -","- C53.5 H58 B Cl F24 O3 P4 Rh2 -","- C214 H232 B4 Cl4 F96 O12 P16 Rh8 -","4","1","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C–H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.0459","0.0377","","","0.0944","0.1013","","","","","","1.029","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076444","9.5764","0.0006","21.346","0.0014","10.0396","0.0006","90","","108.081","0.001","90","","1950.9","0.2","193","2","193","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C25 H44 F6 O11 P4 Rh2 S2 -","- C25 H44 F6 O11 P4 Rh2 S2 -","- C50 H88 F12 O22 P8 Rh4 S4 -","2","0.5","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C‒H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.0242","0.0225","","","0.0611","0.0625","","","","","","1.04","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076445","8.0072","0.0012","18.318","0.003","23.367","0.004","90","","90.877","0.002","90","","3427","1","193","2","193","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C23 H47 F3 Ir O6 P4 Rh S -","- C23 H47 F3 Ir O6 P4 Rh S -","- C92 H188 F12 Ir4 O24 P16 Rh4 S4 -","4","1","","Slaney, Michael E.; Anderson, D. Jason; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Bis(diethylphosphino)methane As a Bridging Ligand in Complexes of Ir2, Rh2, and IrRh: Geminal C‒H Activation of α-Olefins","Organometallics","2012","31","6","2286","","10.1021/om201214z","","","0.71073","MoKα","","0.059","0.0526","","","0.1306","0.1334","","","","","","1.182","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076446","13.617","0.0005","8.7826","0.0003","16.3065","0.0005","90","","90","","90","","1950.14","0.11","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","ser0135","ser0135","","- C19 H25 Cl2 Ir N2 -","- C19 H25 Cl2 Ir N2 -","- C76 H100 Cl8 Ir4 N8 -","4","1","","Meredith, Joseph M.; Robinson, Robert; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","C‒H Bond Activation by Cationic Iridium(III) NHC Complexes: A Combined Experimental and Computational Study","Organometallics","2012","31","5","1879","","10.1021/om2012166","","","0.71073","MoKα","","0.0473","0.0395","","","0.0755","0.0781","","","","","","1.074","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076447","9.1974","0.0002","15.1196","0.0004","24.5587","0.0008","90","","90","","90","","3415.16","0.16","130","2","130","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","JMM02047","JMM02047","","- C17 H29 Ir N2 -","- C17 H29 Ir N2 -","- C136 H232 Ir8 N16 -","8","1","","Meredith, Joseph M.; Robinson, Robert; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","C‒H Bond Activation by Cationic Iridium(III) NHC Complexes: A Combined Experimental and Computational Study","Organometallics","2012","31","5","1879","","10.1021/om2012166","","","0.71073","MoKα","","0.0967","0.0371","","","0.0799","0.0984","","","","","","0.89","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076448","9.0264","0.0003","12.1669","0.0005","16.8721","0.0006","90","","90","","90","","1852.95","0.12","130","2","130","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","JMM02053","JMM02053","","- C19 H33 Ir N2 -","- C19 H33 Ir N2 -","- C76 H132 Ir4 N8 -","4","1","","Meredith, Joseph M.; Robinson, Robert; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","C‒H Bond Activation by Cationic Iridium(III) NHC Complexes: A Combined Experimental and Computational Study","Organometallics","2012","31","5","1879","","10.1021/om2012166","","","0.71073","MoKα","","0.0438","0.0425","","","0.1129","0.1139","","","","","","1.057","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076449","12.1212","0.0004","12.4125","0.0007","13.5343","0.0007","64.004","0.002","68.406","0.002","72.179","0.0017","1676.1","0.14","130","2","130","2","","","","","","","","7","P -1","-P 1","2","JMM02053","JMM02053","","- C68 H52 B2 Cl2 F30 Ir2 N4 -","- C68 H52 B2 Cl2 F30 Ir2 N4 -","- C68 H52 B2 Cl2 F30 Ir2 N4 -","1","0.5","","Meredith, Joseph M.; Robinson, Robert; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","C‒H Bond Activation by Cationic Iridium(III) NHC Complexes: A Combined Experimental and Computational Study","Organometallics","2012","31","5","1879","","10.1021/om2012166","","","0.71073","MoKα","","0.045","0.0361","","","0.079","0.0817","","","","","","0.995","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076450","9.8163","0.0009","11.2358","0.0012","14.9169","0.0014","95.707","0.008","97.126","0.008","113.675","0.009","1474.8","0.3","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C66 H58 Cl6 Fe4 P2 Pd -","- C66 H58 Cl6 Fe4 P2 Pd -","- C66 H58 Cl6 Fe4 P2 Pd -","1","0.5","","Lohan, Manja; Milde, Bianca; Heider, Silvio; Speck, J. Matthäus; Krauße, Sabrina; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Synthesis, Electrochemistry, Spectroelectrochemistry, and Solid-State Structures of Palladium Biferrocenylphosphines and Their Use in C,C Cross-Coupling Reactions","Organometallics","2012","31","6","2310","","10.1021/om201220w","","","0.71073","MoKα","","0.0412","0.0283","","","0.0661","0.0699","","","","","","0.993","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076451","10.7582","0.0004","15.1506","0.0005","26.4251","0.0009","103.956","0.003","92.056","0.003","103.99","0.003","4035.6","0.3","105","","105","","","","","","","","","7","P -1","-P 1","2","","","","- C57.33333 H47.33333 Cl5.33333 Fe4 O4 P2 Pd -","- C57.3333 H47.3333 Cl5.33333 Fe4 O4 P2 Pd -","- C172 H142 Cl16 Fe12 O12 P6 Pd3 -","3","1.5","","Lohan, Manja; Milde, Bianca; Heider, Silvio; Speck, J. Matthäus; Krauße, Sabrina; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Synthesis, Electrochemistry, Spectroelectrochemistry, and Solid-State Structures of Palladium Biferrocenylphosphines and Their Use in C,C Cross-Coupling Reactions","Organometallics","2012","31","6","2310","","10.1021/om201220w","","","0.71073","MoKα","","0.1026","0.0689","","","0.1981","0.2079","","","","","","1.08","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076452","8.1138","0.0004","9.262","0.0003","13.9761","0.0006","91.239","0.003","92.001","0.004","108.578","0.004","994.37","0.08","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H60 Fe2 P2 Se2 -","- C44 H60 Fe2 P2 Se2 -","- C44 H60 Fe2 P2 Se2 -","1","0.5","","Lohan, Manja; Milde, Bianca; Heider, Silvio; Speck, J. Matthäus; Krauße, Sabrina; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Synthesis, Electrochemistry, Spectroelectrochemistry, and Solid-State Structures of Palladium Biferrocenylphosphines and Their Use in C,C Cross-Coupling Reactions","Organometallics","2012","31","6","2310","","10.1021/om201220w","","","0.71073","MoKα","","0.0337","0.0258","","","0.0577","0.0587","","","","","","0.947","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076453","12.0722","0.0007","7.4578","0.0005","15.2042","0.001","90","","92.184","0.005","90","","1367.87","0.15","105","","105","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H31 Fe2 P Se -","- C34 H31 Fe2 P Se -","- C68 H62 Fe4 P2 Se2 -","2","1","","Lohan, Manja; Milde, Bianca; Heider, Silvio; Speck, J. Matthäus; Krauße, Sabrina; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Synthesis, Electrochemistry, Spectroelectrochemistry, and Solid-State Structures of Palladium Biferrocenylphosphines and Their Use in C,C Cross-Coupling Reactions","Organometallics","2012","31","6","2310","","10.1021/om201220w","","","1.54184","CuKα","","0.0451","0.0441","","","0.1163","0.1172","","","","","","1.045","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076454","15.7202","0.0005","11.3121","0.0004","14.716","0.0004","90","","115.506","0.004","90","","2361.88","0.15","105","","105","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H23 Fe2 O2 P Se -","- C28 H23 Fe2 O2 P Se -","- C112 H92 Fe8 O8 P4 Se4 -","4","1","","Lohan, Manja; Milde, Bianca; Heider, Silvio; Speck, J. Matthäus; Krauße, Sabrina; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Synthesis, Electrochemistry, Spectroelectrochemistry, and Solid-State Structures of Palladium Biferrocenylphosphines and Their Use in C,C Cross-Coupling Reactions","Organometallics","2012","31","6","2310","","10.1021/om201220w","","","1.54184","CuKα","","0.0484","0.0384","","","0.1056","0.1221","","","","","","1.104","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076455","11.3208","0.0006","12.0687","0.0008","12.5154","0.0005","66.35","0.004","78.506","0.004","62.778","0.004","1392.59","0.15","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H47 B9 N O3 Re -","- C18 H47 B9 N O3 Re -","- C36 H94 B18 N2 O6 Re2 -","2","1","","Pichaandi, Kothanda Rama; Fanwick, Phillip E.; Abu-Omar, Mahdi M.","Trioxorhena(VII)carborane Anion and Its Methyl-Substituted Analogue: Synthesis, Structure, DFT, and Catalytic Studies","Organometallics","2012","31","5","1888","","10.1021/om201222r","","","1.54178","CuKα","","0.0502","0.0497","","","0.1375","0.1383","","","","","","1.114","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076456","15.6225","0.0004","7.4327","0.0002","28.7002","0.001","90","","95.433","0.003","90","","3317.62","0.17","150","0.2","150","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 B9 O3 P Re -","- C31 H35 B9 O3 P Re -","- C124 H140 B36 O12 P4 Re4 -","4","1","","Pichaandi, Kothanda Rama; Fanwick, Phillip E.; Abu-Omar, Mahdi M.","Trioxorhena(VII)carborane Anion and Its Methyl-Substituted Analogue: Synthesis, Structure, DFT, and Catalytic Studies","Organometallics","2012","31","5","1888","","10.1021/om201222r","","","1.54184","CU-Kα","","0.04","0.039","","","0.109","0.111","","","","","","1.101","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4076457","14.3733","0.001","11.3361","0.0007","19.5318","0.0014","90","","95.052","0.005","90","","3170.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H51 B9 N O3 Re -","- C20 H51 B9 N O3 Re -","- C80 H204 B36 N4 O12 Re4 -","4","1","","Pichaandi, Kothanda Rama; Fanwick, Phillip E.; Abu-Omar, Mahdi M.","Trioxorhena(VII)carborane Anion and Its Methyl-Substituted Analogue: Synthesis, Structure, DFT, and Catalytic Studies","Organometallics","2012","31","5","1888","","10.1021/om201222r","","","1.54184","CU-Kα","","0.078","0.063","","","0.194","0.213","","","","","","1.058","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4076458","12.4708","0.0007","17.0967","0.0009","20.1778","0.0011","73.914","0.001","81.31","0.001","88.824","0.001","4085.2","0.4","168","2","168","2","","","","","","","","9","P -1","-P 1","2","","","","- C147 H180 B4 Br2 Cl6 F48 N4 P4 Pt2 -","- C147 H180 B4 Br2 Cl6 F48 N4 P4 Pt2 -","- C147 H180 B4 Br2 Cl6 F48 N4 P4 Pt2 -","1","0.5","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.047","0.038","","","0.0947","0.0985","","","","","","1.027","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076459","13.915","0.008","27.088","0.012","16.082","0.01","90","","94.89","0.05","90","","6040","6","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H85 B7 Br Cl8 N2 P2 Pt -","- C48 H85 B7 Br Cl8 N2 P2 Pt -","- C192 H340 B28 Br4 Cl32 N8 P8 Pt4 -","4","1","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0413","0.0348","","","0.0875","0.0908","","","","","","1.055","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076460","13.159","0.005","14.312","0.007","17.024","0.01","96.77","0.04","107.58","0.04","96.37","0.05","2999","3","174","2","174","2","","","","","","","","6","P -1","-P 1","2","","","","- C109 H192 B4 Br8 P4 Pt4 -","- C109 H192 B4 Br8 P4 Pt4 -","- C109 H192 B4 Br8 P4 Pt4 -","1","0.5","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0292","0.0226","","","0.054","0.0569","","","","","","1.041","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4076461","13.945","0.0007","14.6747","0.0008","16.4135","0.0009","94.617","0.001","109.732","0.001","110.204","0.001","2892.3","0.3","169","2","169","2","","","","","","","","7","P -1","-P 1","2","","","","- C47 H81 B2 Br5 Cl4 P2 Pt -","- C47 H81 B2 Br5 Cl4 P2 Pt -","- C94 H162 B4 Br10 Cl8 P4 Pt2 -","2","1","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0322","0.0267","","","0.0633","0.0655","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076462","13.3776","0.0009","15.0149","0.001","19.6791","0.0013","105.67","0.003","101.086","0.003","98.557","0.003","3649.6","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C137 H158 B4 Cl6 F48 P4 Pt2 -","- C137 H158 B4 Cl6 F48 P4 Pt2 -","- C137 H158 B4 Cl6 F48 P4 Pt2 -","1","0.5","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0257","0.0233","","","0.0557","0.0572","","","","","","1.035","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076463","9.812","0.002","9.835","0.002","23.552","0.005","86.581","0.004","80.101","0.004","60.653","0.003","1950.8","0.7","171","2","171","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H66 B Cl3 P2 Pt -","- C36 H66 B Cl3 P2 Pt -","- C72 H132 B2 Cl6 P4 Pt2 -","2","1","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0359","0.0305","","","0.062","0.0637","","","","","","1.146","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076464","8.5083","0.0011","10.4735","0.0014","20.746","0.003","104.504","0.006","95.605","0.005","98.582","0.005","1752.1","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H110 B2 Br4 Fe2 P4 Pt2 -","- C63 H110 B2 Br4 Fe2 P4 Pt2 -","- C63 H110 B2 Br4 Fe2 P4 Pt2 -","1","0.5","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0184","0.0172","","","0.0433","0.044","","","","","","1.111","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076465","15.0677","0.0018","17.262","0.002","24.847","0.003","90","","90","","90","","6462.7","1.3","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C60 H63 B2 Br F24 Fe P2 Pt -","- C60 H63 B2 Br F24 Fe P2 Pt -","- C240 H252 B8 Br4 F96 Fe4 P8 Pt4 -","4","1","","Arnold, Nicole; Braunschweig, Holger; Brenner, Peter; Jimenez-Halla, J. Oscar C.; Kupfer, Thomas; Radacki, Krzysztof","Reactivity of Boryl Complexes: Synthesis and Structure of New Neutral and Cationic Platinum Boryls and Borylenes","Organometallics","2012","31","5","1897","","10.1021/om2012248","","","0.71073","MoKα","","0.0212","0.0182","","","0.0378","0.0383","","","","","","1.035","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076466","12.3046","0.0005","11.8986","0.0005","16.7732","0.0007","90","","102.448","0.004","90","","2397.99","0.18","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H31 Al B Cl4 O2 P -","- C18 H31 Al B Cl4 O2 P -","- C72 H124 Al4 B4 Cl16 O8 P4 -","4","1","","Solomon, S. A.; Del Grosso, A.; Clark, E. R.; Bagutski, V.; McDouall, J. J. W.; Ingleson, M. J.","Reactivity of Lewis Acid Activated Diaza- and Dithiaboroles in Electrophilic Arene Borylation","Organometallics","2012","31","5","1908","","10.1021/om201228e","","","0.71073","MoKα","","0.0644","0.0441","","","0.1093","0.1135","","","","","","0.992","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076467","31.816","0.007","7.2892","0.0007","23.376","0.005","90","","128.66","0.03","90","","4233","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H35 B N2 -","- C26 H35 B N2 -","- C208 H280 B8 N16 -","8","1","","Solomon, S. A.; Del Grosso, A.; Clark, E. R.; Bagutski, V.; McDouall, J. J. W.; Ingleson, M. J.","Reactivity of Lewis Acid Activated Diaza- and Dithiaboroles in Electrophilic Arene Borylation","Organometallics","2012","31","5","1908","","10.1021/om201228e","","","0.71073","MoKα","","0.108","0.0643","","","0.128","0.1473","","","","","","1.142","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076468","16.6006","0.0017","7.8289","0.0008","32.897","0.003","90","","93.409","0.004","90","","4267.9","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H38 N2 Ni P2 S -","- C16 H38 N2 Ni P2 S -","- C128 H304 N16 Ni8 P16 S8 -","8","2","","Sgro, Michael J.; Stephan, Douglas W.","Oxidative Addition Reactions of Bis-Aminophosphine and Bis-Phosphinite Nickel(0) Pincer Complexes","Organometallics","2012","31","5","1584","","10.1021/om201229x","","","0.71073","MoKα","","0.0835","0.0442","","","0.0803","0.0919","","","","","","0.994","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076469","9.9317","0.0005","14.2119","0.0008","14.9303","0.0007","90","","98.084","0.001","90","","2086.45","0.19","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 Ni O2 P2 S -","- C16 H36 Ni O2 P2 S -","- C64 H144 Ni4 O8 P8 S4 -","4","1","","Sgro, Michael J.; Stephan, Douglas W.","Oxidative Addition Reactions of Bis-Aminophosphine and Bis-Phosphinite Nickel(0) Pincer Complexes","Organometallics","2012","31","5","1584","","10.1021/om201229x","","","0.71073","MoKα","","0.0339","0.0265","","","0.064","0.0675","","","","","","1.028","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076470","10.202","0.0009","10.549","0.0009","12.3641","0.001","85.328","0.003","67.887","0.002","89.813","0.002","1228.12","0.18","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H40 F6 N3 Ni P3 -","- C16 H40 F6 N3 Ni P3 -","- C32 H80 F12 N6 Ni2 P6 -","2","1","","Sgro, Michael J.; Stephan, Douglas W.","Oxidative Addition Reactions of Bis-Aminophosphine and Bis-Phosphinite Nickel(0) Pincer Complexes","Organometallics","2012","31","5","1584","","10.1021/om201229x","","","0.71073","MoKα","","0.0482","0.0352","","","0.0858","0.092","","","","","","1.048","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076471","8.5536","0.001","31.097","0.004","10.3432","0.0011","90","","108.957","0.006","90","","2602","0.5","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H42 Cl F N3 Ni P2 -","- C22 H42 Cl F N3 Ni P2 -","- C88 H168 Cl4 F4 N12 Ni4 P8 -","4","1","","Sgro, Michael J.; Stephan, Douglas W.","Oxidative Addition Reactions of Bis-Aminophosphine and Bis-Phosphinite Nickel(0) Pincer Complexes","Organometallics","2012","31","5","1584","","10.1021/om201229x","","","0.71073","MoKα","","0.1163","0.0621","","","0.1423","0.1681","","","","","","1.024","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076472","17.2227","0.0007","18.3649","0.0007","11.4794","0.0005","90","","103.965","0.0014","90","","3523.5","0.3","123","2","123","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C38 H55 N Ru3 -","- C38 H40 N Ru3 -","- C152 H160 N4 Ru12 -","4","0.5","","Kanda, Hideyuki; Kawashima, Takashi; Takao, Toshiro; Suzuki, Hiroharu","Reactions of a Triruthenium Pentahydrido Complex with Imines Leading to the Formation of a Perpendicularly Coordinated Iminoacyl Ligand and the Scission of a C═N Bond on a Triruthenium Plane","Organometallics","2012","31","5","1917","","10.1021/om201230u","","","0.71069","MoKα","","0.0579","0.036","","","0.0699","0.0805","","","","","","1.036","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076473","11.6961","0.0002","13.9855","0.0003","33.1265","0.0006","90","","90.1577","0.0007","90","","5418.67","0.18","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H76 B N Ru3 -","- C62 H76 B N Ru3 -","- C248 H304 B4 N4 Ru12 -","4","1","","Kanda, Hideyuki; Kawashima, Takashi; Takao, Toshiro; Suzuki, Hiroharu","Reactions of a Triruthenium Pentahydrido Complex with Imines Leading to the Formation of a Perpendicularly Coordinated Iminoacyl Ligand and the Scission of a C═N Bond on a Triruthenium Plane","Organometallics","2012","31","5","1917","","10.1021/om201230u","","","0.71069","MoKα","","0.0217","0.02","","","0.0488","0.0497","","","","","","1.046","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076474","10.7482","0.00019","39.424","0.0007","19.0321","0.0004","90","","91.272","0.0007","90","","8062.6","0.3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H56 F3 N Ru3 -","- C44 H56 F3 N Ru3 -","- C352 H448 F24 N8 Ru24 -","8","2","","Kanda, Hideyuki; Kawashima, Takashi; Takao, Toshiro; Suzuki, Hiroharu","Reactions of a Triruthenium Pentahydrido Complex with Imines Leading to the Formation of a Perpendicularly Coordinated Iminoacyl Ligand and the Scission of a C═N Bond on a Triruthenium Plane","Organometallics","2012","31","5","1917","","10.1021/om201230u","","","0.71069","MoKα","","0.0376","0.0291","","","0.0659","0.0699","","","","","","1.034","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076475","17.564","0.0009","18.2158","0.001","11.1919","0.0007","90","","103.173","0.0018","90","","3486.5","0.3","153","2","153","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C37 H53 N Ru3 -","- C37 H53 N Ru3 -","- C148 H212 N4 Ru12 -","4","0.5","","Kanda, Hideyuki; Kawashima, Takashi; Takao, Toshiro; Suzuki, Hiroharu","Reactions of a Triruthenium Pentahydrido Complex with Imines Leading to the Formation of a Perpendicularly Coordinated Iminoacyl Ligand and the Scission of a C═N Bond on a Triruthenium Plane","Organometallics","2012","31","5","1917","","10.1021/om201230u","","","0.71069","MoKα","","0.038","0.0303","","","0.0698","0.0736","","","","","","1.068","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076476","11.0247","0.0006","11.0361","0.0007","14.8713","0.0009","106.4","0.0016","95.224","0.0016","113.981","0.0014","1541.6","0.16","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H49 N Ru3 -","- C32 H30 N Ru3 -","- C64 H60 N2 Ru6 -","2","1","","Kanda, Hideyuki; Kawashima, Takashi; Takao, Toshiro; Suzuki, Hiroharu","Reactions of a Triruthenium Pentahydrido Complex with Imines Leading to the Formation of a Perpendicularly Coordinated Iminoacyl Ligand and the Scission of a C═N Bond on a Triruthenium Plane","Organometallics","2012","31","5","1917","","10.1021/om201230u","","","0.71069","MoKα","","0.1164","0.064","","","0.1393","0.1832","","","","","","1.159","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076477","15.3988","0.0009","8.198","0.0004","16.2972","0.001","90","","90","","90","","2057.3","0.2","291","2","291","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C22 H26 N2 O3 -","- C22 H26 N2 O3 -","- C88 H104 N8 O12 -","4","0.5","","Braun, Markus; Frank, Walter; Ganter, Christian","Reactivity of an Oxalamide-Based N-Heterocyclic Carbene","Organometallics","2012","31","5","1927","","10.1021/om201235c","","","0.71073","MoKα","","0.065","0.0482","","","0.1543","0.161","","","","","","1.067","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076478","11.2248","0.0005","32.4746","0.0018","11.1989","0.0005","90","","90","","90","","4082.2","0.3","291","2","291","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C21 H22 N2 O2 Se -","- C21 H22 N2 O2 Se -","- C168 H176 N16 O16 Se8 -","8","0.5","","Braun, Markus; Frank, Walter; Ganter, Christian","Reactivity of an Oxalamide-Based N-Heterocyclic Carbene","Organometallics","2012","31","5","1927","","10.1021/om201235c","","","0.71073","MoKα","","0.0367","0.0296","","","0.0632","0.0645","","","","","","1.048","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076479","13.0623","0.0004","16.4429","0.0005","19.0786","0.0007","90","","90","","90","","4097.7","0.2","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C43 H48 Cl2 N4 O5 -","- C43 H48 Cl2 N4 O5 -","- C172 H192 Cl8 N16 O20 -","4","1","","Braun, Markus; Frank, Walter; Ganter, Christian","Reactivity of an Oxalamide-Based N-Heterocyclic Carbene","Organometallics","2012","31","5","1927","","10.1021/om201235c","","","0.71073","MoKα","","0.0779","0.0691","","","0.1297","0.1328","","","","","","1.215","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076480","11.3659","0.0007","15.1471","0.0006","15.9812","0.001","90","","98.205","0.007","90","","2723.2","0.3","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 Cl N2 O2 Rh -","- C29 H34 Cl N2 O2 Rh -","- C116 H136 Cl4 N8 O8 Rh4 -","4","1","","Braun, Markus; Frank, Walter; Ganter, Christian","Reactivity of an Oxalamide-Based N-Heterocyclic Carbene","Organometallics","2012","31","5","1927","","10.1021/om201235c","","","0.71073","MoKα","","0.0484","0.0338","","","0.0785","0.0878","","","","","","1.002","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076481","8.3096","0.0009","12.7502","0.0014","20.107","0.002","90","","99.447","0.002","90","","2101.4","0.4","100","0.1","100","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Li-1","[Rh(bdmpza)Cl3]Li.H2O","","- C16 H25 Cl3 Li N4 O4 Rh -","- C16 H25 Cl3 Li N4 O4 Rh -","- C64 H100 Cl12 Li4 N16 O16 Rh4 -","4","1","","Rhinehart, Jennifer L.; Manbeck, Kimberly A.; Buzak, Sara K.; Lippa, Geoffrey M.; Brennessel, William W.; Goldberg, Karen I.; Jones, William D.","Catalytic Arene H/D Exchange with Novel Rhodium and Iridium Complexes","Organometallics","2012","31","5","1943","","10.1021/om2012419","","","0.71073","MoKα","","0.1041","0.0576","","","0.0856","0.097","","","","","","1.034","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076482","10.402","0.008","12.261","0.01","19.677","0.015","90","","100.66","0.011","90","","2466","3","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Et4N-1","[Rh(bdmpza)Cl3]Et4N","","- C20 H35 Cl3 N5 O2 Rh -","- C20 H35 Cl3 N5 O2 Rh -","- C80 H140 Cl12 N20 O8 Rh4 -","4","1","","Rhinehart, Jennifer L.; Manbeck, Kimberly A.; Buzak, Sara K.; Lippa, Geoffrey M.; Brennessel, William W.; Goldberg, Karen I.; Jones, William D.","Catalytic Arene H/D Exchange with Novel Rhodium and Iridium Complexes","Organometallics","2012","31","5","1943","","10.1021/om2012419","","","0.71073","MoKα","","0.2489","0.1326","","","0.2673","0.3113","","","","","","1.219","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076483","8.5743","0.001","14.2503","0.0017","13.7914","0.0016","90","","90","","90","","1685.1","0.3","100","0.1","100","0.1","","","","","","","","7","P n m a","-P 2ac 2n","62","Na-2","[Ir(bdmpza)Cl3]Na","","- C12 H15 Cl3 Ir N4 Na O2 -","- C12 H15 Cl3 Ir N4 Na O2 -","- C48 H60 Cl12 Ir4 N16 Na4 O8 -","4","0.5","","Rhinehart, Jennifer L.; Manbeck, Kimberly A.; Buzak, Sara K.; Lippa, Geoffrey M.; Brennessel, William W.; Goldberg, Karen I.; Jones, William D.","Catalytic Arene H/D Exchange with Novel Rhodium and Iridium Complexes","Organometallics","2012","31","5","1943","","10.1021/om2012419","","","0.71073","MoKα","","0.0744","0.041","","","0.0904","0.1023","","","","","","1.025","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076484","11.8837","0.0013","13.549","0.0015","12.5024","0.0014","90","","103.821","0.002","90","","1954.8","0.4","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","3a","Rh(bdmpza)Cl2(py)","","- C17 H20 Cl2 N5 O2 Rh -","- C17 H20 Cl2 N5 O2 Rh -","- C68 H80 Cl8 N20 O8 Rh4 -","4","1","","Rhinehart, Jennifer L.; Manbeck, Kimberly A.; Buzak, Sara K.; Lippa, Geoffrey M.; Brennessel, William W.; Goldberg, Karen I.; Jones, William D.","Catalytic Arene H/D Exchange with Novel Rhodium and Iridium Complexes","Organometallics","2012","31","5","1943","","10.1021/om2012419","","","0.71073","MoKα","","0.0769","0.0438","","","0.0981","0.1114","","","","","","1.022","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076485","20.972","0.003","20.972","0.003","15.313","0.004","90","","90","","90","","6735","2","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C34 H28 Br4 Mn4 N8 O14 -","- C34.0016 H28 Br4.0016 Mn4 N8 O14.0016 -","- C136.006 H112 Br16.0064 Mn16 N32 O56.0064 -","4","0.25","","Karthikeyan, S.; Velavan, K.; Sathishkumar, Ranganathan; Varghese, Babu; Manimaran, Bala.","Self-Assembly of Manganese(I)-Based Molecular Squares: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2012","31","5","1953","","10.1021/om201244a","","","0.71073","MoKα","","0.1518","0.0763","","","0.1667","0.1942","","","","","","0.928","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076486","15.4691","0.0007","15.4691","0.0007","27.759","0.003","90","","90","","90","","6642.5","0.8","150","2","150","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C58 H44 Br4 Mn4 N8 O14 -","- C57.996 H32 Br4 Mn4 N8 O14 -","- C231.984 H128 Br16 Mn16 N32 O56 -","4","0.25","","Karthikeyan, S.; Velavan, K.; Sathishkumar, Ranganathan; Varghese, Babu; Manimaran, Bala.","Self-Assembly of Manganese(I)-Based Molecular Squares: Synthesis and Spectroscopic and Structural Characterization","Organometallics","2012","31","5","1953","","10.1021/om201244a","","","0.71073","MoKα","","0.0674","0.0555","","","0.146","0.1523","","","","","","1.178","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076487","18.4395","0.0005","18.7543","0.0006","21.2127","0.0007","107.827","0.003","113.792","0.003","91.08","0.002","6304.2","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","LGeN(H)Ar","","","- C33 H47 Ge N3 -","- C33 H47 Ge N3 -","- C264 H376 Ge8 N24 -","8","4","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","1.54178","CuKα","","0.0746","0.0601","","","0.1788","0.2148","","","","","","1.148","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076488","20.471","0.004","10.096","0.002","11.032","0.002","90","","90","","90","","2280","0.8","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","LAlMe(Cl)","","","- C22 H32 Al Cl N2 -","- C22 H32 Al Cl N2 -","- C88 H128 Al4 Cl4 N8 -","4","1","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","0.71073","MoKα","","0.0466","0.037","","","0.0968","0.1057","","","","","","1.077","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076489","14.375","0.004","12.78","0.004","26.191","0.008","90","","93.457","0.006","90","","4803","2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","LH.AlMe2Cl","","","- C22.75 H35.25 Al Cl1.25 N2 -","- C22.788 H35.364 Al Cl1.212 N2 -","- C182.304 H282.912 Al8 Cl9.696 N16 -","8","2","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","0.71073","MoKα","","0.1116","0.0995","","","0.1976","0.2044","","","","","","1.115","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076490","9.7417","0.0002","18.6543","0.0005","17.6245","0.0005","90","","102.034","0.003","90","","3132.42","0.14","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","LH.AlCl3","","","- C54 H80 Al2 Cl6 N4 O3 -","- C54 H80 Al2 Cl6 N4 O3 -","- C108 H160 Al4 Cl12 N8 O6 -","2","0.5","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","0.71073","MoKα","","0.0723","0.053","","","0.1232","0.1317","","","","","","1.032","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076491","14.935","0.003","13.868","0.003","17.071","0.003","90","","91.06","0.03","90","","3535.1","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","L'(NEt2)Al(NEt2)Li(THF)","","","- C34 H60 Al Li N4 O -","- C34 H60 Al Li N4 O -","- C136 H240 Al4 Li4 N16 O4 -","4","1","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","0.71073","MoKα","","0.0776","0.0682","","","0.2031","0.213","","","","","","1.065","","","","has coordinates,has disorder","178653","2020-10-21","18:00:00",""
"4076492","10.305","0.002","11.761","0.002","26.29","0.005","87.97","0.03","89.23","0.03","64.78","0.03","2880.7","1.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","L'(PPh2)AlMe(OC4H8-PPh2)Li(THF)2","","","- C61 H83 Al Li N2 O3 P2 -","- C61 H83 Al Li N2 O3 P2 -","- C122 H166 Al2 Li2 N4 O6 P4 -","2","1","","Yang, Ying; Zhao, Na; Zhu, Hongping; Roesky, Herbert W.","Syntheses and Reactions of Derivatives of (Pyrrolylaldiminato)germanium(II) and -Aluminum(III)","Organometallics","2012","31","5","1958","","10.1021/om201252k","","","0.71073","MoKα","","0.2553","0.1081","","","0.248","0.3278","","","","","","0.995","","","","has coordinates","178653","2020-10-21","18:00:00",""
"4076493","32.3018","0.0014","14.9286","0.0007","16.9824","0.0008","90","","110.525","0.002","90","","7669.4","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H53 N5 O Ti -","- C43 H53 N5 O Ti -","- C344 H424 N40 O8 Ti8 -","8","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.1333","0.0677","","","0.1063","0.1088","","","","","","2.491","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4076494","16.6663","0.0007","11.7383","0.0005","18.243","0.0007","90","","104.524","0.002","90","","3454.9","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H45 N5 Zr -","- C39 H45 N5 Zr -","- C156 H180 N20 Zr4 -","4","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.0491","0.0325","","","0.0505","0.0515","","","","","","1.774","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076495","36.2843","0.0015","11.6553","0.0005","16.971","0.0008","90","","109.665","0.002","90","","6758.5","0.5","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C39 H41 Cl2 N3 O Ti -","- C39 H41 Cl2 N3 O Ti -","- C312 H328 Cl16 N24 O8 Ti8 -","8","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.0703","0.042","","","0.0523","0.0533","","","","","","1.938","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4076496","17.1199","0.0007","23.1437","0.001","34.8624","0.0015","90","","90","","90","","13813.1","1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40.25 H39 Cl2 N3 Zr -","- C40.25 H39 Cl2 N3 Zr -","- C644 H624 Cl32 N48 Zr16 -","16","4","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.0527","0.0345","","","0.0543","0.0553","","","","","","1.589","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4076497","11.7169","0.0005","12.7754","0.0006","13.0786","0.0006","61.415","0.002","85.745","0.003","85.899","0.003","1712.89","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H41 Cl2 N3 O Zr -","- C39 H41 Cl2 N3 O Zr -","- C78 H82 Cl4 N6 O2 Zr2 -","2","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.054","0.0381","","","0.0678","0.0693","","","","","","1.957","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4076498","10.5191","0.0004","12.8102","0.0005","20.6372","0.0008","96.952","0.002","90.511","0.002","98.726","0.002","2727.45","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H79 N3 Zr -","- C64 H79 N3 Zr -","- C128 H158 N6 Zr2 -","2","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.0466","0.0352","","","0.0492","0.0499","","","","","","1.925","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4076499","13.2349","0.0005","17.656","0.0008","19.0978","0.0008","90","","102.355","0.002","90","","4359.3","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C51 H67 N3 -","- C51 H67 N3 -","- C204 H268 N12 -","4","1","","Tonks, Ian A.; Tofan, Daniel; Weintrob, Edward C.; Agapie, Theodor; Bercaw, John E.","Zirconium and Titanium Propylene Polymerization Precatalysts Supported by a FluxionalC2-Symmetric Bis(anilide)pyridine Ligand","Organometallics","2012","31","5","1965","","10.1021/om201262h","","","0.71073","MoKα","","0.0986","0.0641","","","0.0867","0.0886","","","","","","2.513","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076500","13.1164","0.0012","14.1721","0.0012","17.7987","0.0014","77.124","0.007","82.581","0.007","68.966","0.008","3006","0.5","110","","110","","","","","","","","","4","P -1","-P 1","2","","","","- C78.5 H66 Fe6 S2 -","- C78.5 H66 Fe6 S2 -","- C157 H132 Fe12 S4 -","2","1","","Speck, J. Matthäus; Schaarschmidt, Dieter; Lang, Heinrich","Atropisomeric 3,3′,4,4′,5,5′-Hexaferrocenyl-2,2′-bithiophene: Synthesis, Solid-State Structure, and Electrochemistry","Organometallics","2012","31","5","1975","","10.1021/om201266y","","","0.71073","MoKα","","0.0636","0.0375","","","0.0773","0.0807","","","","","","0.868","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4076501","12.203","0.005","12.279","0.005","12.413","0.005","90","","90","","90","","1860","1.3","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H33 Co N P3 -","- C12 H33 Co N P3 -","- C48 H132 Co4 N4 P12 -","4","1","","Xu, Hongwei; Williard, Paul G.; Bernskoetter, Wesley H.","C‒CN Bond Activation of Acetonitrile using Cobalt(I)","Organometallics","2012","31","5","1588","","10.1021/om201270n","","","0.71073","MoKα","","0.0492","0.0447","","","0.1134","0.1184","","","","","","1.086","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076502","11.5404","0.0014","17.8908","0.0014","13.864","0.003","90","","112.408","0.011","90","","2646.3","0.7","100","","100","","","","","","","","tetrahydrofuran","6","P 1 21/m 1","-P 2yb","11","","(E,E)-1,6,11-tris(4-tolylsulfonyl)-1,6,11-triazacyclopentadeca-3,8-diene- 13-ynenickel(0)-1,5-cyclooctadiene-nickel(0) penta-tetrahydrofuran solute","","- C53 H77 N3 Ni O11 S3 -","- C52.92 H37 N3 Ni O10.98 S3 -","- C105.84 H74 N6 Ni2 O21.96 S6 -","2","0.5","","Brun, Sandra; Pla-Quintana, Anna; Roglans, Anna; Pörschke, Klaus-Richard; Goddard, Richard","Nickel(0) Complexes of Polyunsaturated Azamacrocyclic Ligands","Organometallics","2012","31","5","1983","","10.1021/om201271y","","","0.71073","MoKα","","0.1228","0.073","","","0.1567","0.181","","","","","","1.054","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4076503","18.539","0.003","18.881","0.003","11.2747","0.0015","90","","90","","90","","3946.5","1","100","","100","","","","","","","","tetrahydrofuran","6","P n m a","-P 2ac 2n","62","","(E,E)-1,6,11-tris(4-tolylsulfonyl)-1,6,11-triazacyclopentadeca-3,8-diene- 13-yne-nickel(0)-1,5-cyclooctadiene-nickel(0)","","- C39.67 H47 N3 Ni1.83 O6 S3 -","- C39.672 H47.008 N3 Ni1.834 O6 S3 -","- C158.688 H188.032 N12 Ni7.336 O24 S12 -","4","0.5","","Brun, Sandra; Pla-Quintana, Anna; Roglans, Anna; Pörschke, Klaus-Richard; Goddard, Richard","Nickel(0) Complexes of Polyunsaturated Azamacrocyclic Ligands","Organometallics","2012","31","5","1983","","10.1021/om201271y","","","0.71073","Mo-Kα","","0.1214","0.0857","","","0.2024","0.2199","","","","","","1.163","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076504","12.7365","0.0017","13.2256","0.0017","20.124","0.003","90","","90","","90","","3389.8","0.8","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C30 H51 B2 F4 N6 O Os P -","- C30 H51 B2 F4 N6 O Os P -","- C120 H204 B8 F16 N24 O4 Os4 P4 -","4","1","","Castro-Rodrigo, Ruth; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Anti-Markovnikov 1,3-CH Addition of Allenes to Allenes: A Straightforward Method To Prepare Osmium‒Dienylcarbene Complexes","Organometallics","2012","31","5","1991","","10.1021/om201272q","","","0.71073","MoKα","","0.0627","0.0436","","","0.0756","0.0828","","","","","","0.998","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076505","13.2854","0.0013","20.752","0.002","28.06","0.003","90","","91.672","0.001","90","","7732.8","1.3","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C68.35 H71.71 B2 Cl0.71 F24 N6 Os P -","- C68.354 H71.708 B2 Cl0.708 F24 N6 Os P -","- C273.416 H286.832 B8 Cl2.832 F96 N24 Os4 P4 -","4","1","","Castro-Rodrigo, Ruth; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Anti-Markovnikov 1,3-CH Addition of Allenes to Allenes: A Straightforward Method To Prepare Osmium‒Dienylcarbene Complexes","Organometallics","2012","31","5","1991","","10.1021/om201272q","","","0.71073","MoKα","","0.1363","0.0861","","","0.2063","0.2311","","","","","","1.045","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076506","13.397","0.002","16.445","0.003","18.943","0.003","93.825","0.002","108.678","0.002","104.976","0.002","3768","1.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C73 H83 B2 F24 N6 Os P -","- C73 H83 B2 F24 N6 Os P -","- C146 H166 B4 F48 N12 Os2 P2 -","2","1","","Castro-Rodrigo, Ruth; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Anti-Markovnikov 1,3-CH Addition of Allenes to Allenes: A Straightforward Method To Prepare Osmium‒Dienylcarbene Complexes","Organometallics","2012","31","5","1991","","10.1021/om201272q","","","0.71073","MoKα","","0.0581","0.0448","","","0.1149","0.1251","","","","","","1.083","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076507","12.2995","0.0016","16.471","0.002","18.697","0.002","90","","99.903","0.002","90","","3731.3","0.8","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H53 B2 F4 N6 O2 Os P -","- C33 H53 B2 F4 N6 O2 Os P -","- C132 H212 B8 F16 N24 O8 Os4 P4 -","4","1","","Castro-Rodrigo, Ruth; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Anti-Markovnikov 1,3-CH Addition of Allenes to Allenes: A Straightforward Method To Prepare Osmium‒Dienylcarbene Complexes","Organometallics","2012","31","5","1991","","10.1021/om201272q","","","0.71073","MoKα","","0.099","0.0433","","","0.0872","0.1063","","","","","","1.019","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076508","7.5995","0.0011","9.4638","0.0014","20.008","0.003","92.218","0.003","93.955","0.003","113.068","0.003","1317.4","0.3","298","1","298","1","","","","","","","","3","P -1","-P 1","2","","","","- C34 H26 Si -","- C34 H26 Si -","- C68 H52 Si2 -","2","1","","Alonso, Francisco; Buitrago, Robison; Moglie, Yanina; Sepúlveda-Escribano, Antonio; Yus, Miguel","Selective Hydrosilylation of 1,3-Diynes Catalyzed by Titania-Supported Platinum","Organometallics","2012","31","6","2336","","10.1021/om201274v","","","0.71073","MoKα","","0.0843","0.0488","","","0.112","0.127","","","","","","1.014","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076509","19.862","0.0014","8.3618","0.0002","27.6873","0.0018","90","","95.56","0.003","90","","4576.7","0.5","291","2","291","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C48 H54 Br2 N6 O -","- C48 H54 Br2 N6 O -","- C192 H216 Br8 N24 O4 -","4","0.5","","Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian","Diamino- and Mixed Amino–Amido-N-Heterocyclic Carbenes Based on Triazine Backbones","Organometallics","2012","31","5","2001","","10.1021/om201275z","","","0.71073","MoKα","","0.0871","0.0635","","","0.0982","0.1026","","","","","","1.395","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076510","9.2617","0.0004","9.2617","0.0004","20.5439","0.0009","90","","90","","120","","1526.14","0.11","291","2","291","2","","","","","","","","4","P 31","P 31","144","","","","- C24 H25 N3 S -","- C24 H25 N3 S -","- C72 H75 N9 S3 -","3","1","","Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian","Diamino- and Mixed Amino–Amido-N-Heterocyclic Carbenes Based on Triazine Backbones","Organometallics","2012","31","5","2001","","10.1021/om201275z","","","0.71073","MoKα","","0.0649","0.0553","","","0.1378","0.1437","","","","","","1.076","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076511","22.3837","0.0007","7.053","0.0003","12.7219","0.0004","90","","98.65","0.003","90","","1985.59","0.12","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 Br N3 O Rh -","- C20 H27 Br N3 O Rh -","- C80 H108 Br4 N12 O4 Rh4 -","4","1","","Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian","Diamino- and Mixed Amino‒Amido-N-Heterocyclic Carbenes Based on Triazine Backbones","Organometallics","2012","31","5","2001","","10.1021/om201275z","","","0.71073","MoKα","","0.0461","0.0419","","","0.1139","0.1166","","","","","","1.093","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076512","28.201","0.006","11.827","0.003","10.764","0.002","90","","106.932","0.005","90","","3434.5","1.3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H31 Au2 Cl3 N2 P2 -","- C32.5 H31 Au2 Cl3 N2 P2 -","- C130 H124 Au8 Cl12 N8 P8 -","4","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo","Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold–Arene Interactions","Organometallics","2012","31","6","2343","","10.1021/om201276w","","","0.71073","MoKα","","0.1151","0.0773","","","0.1904","0.2274","","","","","","1.075","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076513","9.6892","0.0004","14.2541","0.0005","12.314","0.0005","90","","105.922","0.004","90","","1635.45","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H32 Au2 Cl2 N2 P2 -","- C36 H32 Au2 Cl2 N2 P2 -","- C72 H64 Au4 Cl4 N4 P4 -","2","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo","Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold‒Arene Interactions","Organometallics","2012","31","6","2343","","10.1021/om201276w","","","0.71073","MoKα","","0.0467","0.0315","","","0.0744","0.0785","","","","","","0.932","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076514","9.8229","0.0018","11.518","0.002","15.667","0.003","69.607","0.003","82.607","0.003","72.291","0.003","1582.2","0.5","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H58 Au4 Cl8 N2 P4 -","- C64 H58 Au4 Cl8 N2 P4 -","- C64 H58 Au4 Cl8 N2 P4 -","1","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo","Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold‒Arene Interactions","Organometallics","2012","31","6","2343","","10.1021/om201276w","","","0.71073","MoKα","","0.0407","0.0295","","","0.0878","0.094","","","","","","1.095","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076515","17.476","0.003","11.628","0.002","17.143","0.003","90","","117.887","0.003","90","","3079.1","0.9","110","2","110","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C64 H56 Au4 Cl4 N2 O0 P4 -","- C64 H56 Au4 Cl4 N2 P4 -","- C128 H112 Au8 Cl8 N4 P8 -","2","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo","Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold‒Arene Interactions","Organometallics","2012","31","6","2343","","10.1021/om201276w","","","0.71073","MoKα","","0.0712","0.0433","","","0.1051","0.1244","","","","","","1.021","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076516","15.4246","0.0006","16.2064","0.0005","20.1659","0.0007","83.889","0.001","85.136","0.001","74.773","0.001","4827.9","0.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H52 Au4 Cl4 N2 P4 -","- C58 H52 Au4 Cl4 N2 P4 -","- C174 H156 Au12 Cl12 N6 P12 -","3","1.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Huang, Ting-Hong; Wang, Xiu-Jian; Gui, Liu-Cheng; Yang, Kun-Guo","Gold(I) Chloride Complexes of Polyphosphine Ligands with Electron-Rich Arene Spacer: Gold‒Arene Interactions","Organometallics","2012","31","6","2343","","10.1021/om201276w","","","0.71073","MoKα","","0.0895","0.0591","","","0.1512","0.1874","","","","","","1.139","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076517","9.9932","0.0012","11.059","0.0014","19.449","0.003","76.138","0.013","83.944","0.01","85.539","0.012","2072.1","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H29 N3 Ni -","- C23 H29 N3 Ni -","- C92 H116 N12 Ni4 -","4","2","","Breitenfeld, Jan; Scopelliti, Rosario; Hu, Xile","Synthesis, Reactivity, and Catalytic Application of a Nickel Pincer Hydride Complex","Organometallics","2012","31","6","2128","","10.1021/om201279j","","","0.71073","MoKα","","0.06","0.0433","","","0.0996","0.111","","","","","","1.061","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076518","12.066","0.003","12.7657","0.0018","18.651","0.003","90","","93.517","0.018","90","","2867.4","0.9","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H40 N6 Ni -","- C32 H40 N6 Ni -","- C128 H160 N24 Ni4 -","4","1","","Breitenfeld, Jan; Scopelliti, Rosario; Hu, Xile","Synthesis, Reactivity, and Catalytic Application of a Nickel Pincer Hydride Complex","Organometallics","2012","31","6","2128","","10.1021/om201279j","","","0.71073","MoKα","","0.1115","0.0855","","","0.2316","0.2446","","","","","","1.194","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076519","18.96","0.004","10.792","0.002","27.945","0.006","90","","99.235","0.004","90","","5644","2","173","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H82 Fe N P2 -","- C64 H82 Fe N P2 -","- C256 H328 Fe4 N4 P8 -","4","1","","Nakajima, Yumiko; Ozawa, Fumiyuki","Redox Chemistry of Bis(phosphaethenyl)pyridine Iron Complexes","Organometallics","2012","31","5","2009","","10.1021/om201280z","","","0.7107","MoKα","","0.1488","0.0781","","","0.1824","0.2337","","","","","","1.077","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076520","16.2808","0.0002","17.5874","0.0002","22.8589","0.0004","96.1553","0.0006","106.015","0.0007","114.773","0.001","5523.06","0.15","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H83 Fe N O P2 -","- C60 H83 Fe N O P2 -","- C240 H332 Fe4 N4 O4 P8 -","4","2","","Nakajima, Yumiko; Ozawa, Fumiyuki","Redox Chemistry of Bis(phosphaethenyl)pyridine Iron Complexes","Organometallics","2012","31","5","2009","","10.1021/om201280z","","","0.71069","synchrotron","","0.098","0.0578","","","0.1552","0.1689","","","","","","0.652","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076521","41.171","0.011","9.514","0.003","27.1","0.015","90","","107.47","0.015","90","","10125","7","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H73 Fe N P2 -","- C56 H73 Fe N P2 -","- C448 H584 Fe8 N8 P16 -","8","1","","Nakajima, Yumiko; Ozawa, Fumiyuki","Redox Chemistry of Bis(phosphaethenyl)pyridine Iron Complexes","Organometallics","2012","31","5","2009","","10.1021/om201280z","","","0.71075","MoKα","","0.2254","0.1195","","","0.253","0.3277","","","","","","1.073","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076522","12.3871","0.0003","17.3272","0.0004","24.7286","0.0004","93.665","0.002","103.91","0.002","91.174","0.002","5137.9","0.2","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H67 Al N2 O3 -","- C62 H67 Al N2 O3 -","- C248 H268 Al4 N8 O12 -","4","2","","Chen, Hsiao-Li; Dutta, Saikat; Huang, Pei-Ying; Lin, Chu-Chieh","Preparation and Characterization of Aluminum Alkoxides Coordinated on salen-Type Ligands: Highly Stereoselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2012","31","5","2016","","10.1021/om201281w","","","0.71073","MoKα","","0.0699","0.0391","","","0.0828","0.0865","","","","","","1.001","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076523","12.6013","0.0007","12.8198","0.0008","17.4515","0.0008","94.712","0.005","105.049","0.005","97.372","0.005","2680.3","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C67 H70 Al N2 O3 -","- C67 H70 Al N2 O3 -","- C134 H140 Al2 N4 O6 -","2","1","","Chen, Hsiao-Li; Dutta, Saikat; Huang, Pei-Ying; Lin, Chu-Chieh","Preparation and Characterization of Aluminum Alkoxides Coordinated on salen-Type Ligands: Highly Stereoselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2012","31","5","2016","","10.1021/om201281w","","","0.71073","MoKα","","0.0653","0.0454","","","0.1125","0.1175","","","","","","1.006","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076524","12.1106","0.0004","13.2675","0.0004","19.3795","0.0006","79.073","0.003","77.391","0.003","86.618","0.002","2983.15","0.17","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H86 Al2 N2 O2 -","- C66 H86 Al2 N2 O2 -","- C132 H172 Al4 N4 O4 -","2","1","","Chen, Hsiao-Li; Dutta, Saikat; Huang, Pei-Ying; Lin, Chu-Chieh","Preparation and Characterization of Aluminum Alkoxides Coordinated on salen-Type Ligands: Highly Stereoselective Ring-Opening Polymerization ofrac-Lactide","Organometallics","2012","31","5","2016","","10.1021/om201281w","","","0.71073","MoKα","","0.0636","0.0498","","","0.1554","0.1626","","","","","","1.015","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076525","10.2719","0.0017","18.659","0.003","14.278","0.002","90","","96.798","0.002","90","","2717.3","0.7","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H32 B Fe O2 P -","- C31 H32 B Fe O2 P -","- C124 H128 B4 Fe4 O8 P4 -","4","1","","Kubo, Kazuyuki; Kawanaka, Tomohiro; Tomioka, Masao; Mizuta, Tsutomu","Synthesis and Crystal Structures ofP-Iron-Substituted Phosphinoborane Monomers","Organometallics","2012","31","5","2026","","10.1021/om201287s","","","0.71073","MoKα","","0.087","0.0464","","","0.101","0.1214","","","","","","1.031","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076526","11.6059","0.0013","12.6911","0.0015","21.79","0.003","86.175","0.001","80.838","0.001","86.113","0.002","3156.2","0.7","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C35.5 H41.5 B Fe O2 P -","- C35.5 H41.5 B Fe O2 P -","- C142 H166 B4 Fe4 O8 P4 -","4","2","","Kubo, Kazuyuki; Kawanaka, Tomohiro; Tomioka, Masao; Mizuta, Tsutomu","Synthesis and Crystal Structures ofP-Iron-Substituted Phosphinoborane Monomers","Organometallics","2012","31","5","2026","","10.1021/om201287s","","","0.71073","MoKα","","0.0481","0.0369","","","0.0887","0.0962","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076527","10.44","0.0001","15.394","0.0001","25.112","0.0003","90","","99.131","0.001","90","","3984.69","0.07","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H57 B Fe O2 P -","- C43 H57 B Fe O2 P -","- C172 H228 B4 Fe4 O8 P4 -","4","1","","Kubo, Kazuyuki; Kawanaka, Tomohiro; Tomioka, Masao; Mizuta, Tsutomu","Synthesis and Crystal Structures ofP-Iron-Substituted Phosphinoborane Monomers","Organometallics","2012","31","5","2026","","10.1021/om201287s","","","0.71069","MoKα","","0.0615","0.0475","","","0.1071","0.1181","","","","","","1.064","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076528","11.464","0.0002","18.921","0.0003","17.694","0.0004","90","","90.648","0.001","90","","3837.77","0.13","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H56 B Fe O2 P -","- C43 H56 B Fe O2 P -","- C172 H224 B4 Fe4 O8 P4 -","4","1","","Kubo, Kazuyuki; Kawanaka, Tomohiro; Tomioka, Masao; Mizuta, Tsutomu","Synthesis and Crystal Structures ofP-Iron-Substituted Phosphinoborane Monomers","Organometallics","2012","31","5","2026","","10.1021/om201287s","","","0.71069","MoKα","","0.0558","0.0438","","","0.1032","0.1096","","","","","","1.036","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076529","35.9186","0.001","9.753","0.0003","13.6534","0.0003","90","","112.107","0.0016","90","","4431.3","0.2","200","","200","","","","","","","","Research School of Chemistry","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H29 B Cl N4 Si -","- C19 H29 B Cl N4 Si -","- C152 H232 B8 Cl8 N32 Si8 -","8","1","","Cade, Ian A.; Hill, Anthony F.","1,1-Bis(N-methylimidazole)-2-(trimethylsilyl)-1-boracyclohexa-1,4-diene Chloride: A Stable Intermediate or Tangent en Route to 1-(N-Methylimidazole)borabenzene?","Organometallics","2012","31","5","2112","","10.1021/om300002y","","","0.71073","MoKα","","0.0616","0.0453","","0.1958","0.1652","0.1958","","","","","","0.8612","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076530","12.7787","0.0002","10.0476","0.0002","18.6854","0.0003","90","","108.326","0.0009","90","","2277.44","0.07","200","","200","","","","","","","","Research School of Chemistry","7","P 1 2/a 1","-P 2ya","13","","","","- C19 H31 B Cl N4 O Si -","- C19 H31 B Cl N4 O Si -","- C76 H124 B4 Cl4 N16 O4 Si4 -","4","1","","Cade, Ian A.; Hill, Anthony F.","1,1-Bis(N-methylimidazole)-2-(trimethylsilyl)-1-boracyclohexa-1,4-diene Chloride: A Stable Intermediate or Tangent en Route to 1-(N-Methylimidazole)borabenzene?","Organometallics","2012","31","5","2112","","10.1021/om300002y","","","0.71073","MoKα","","0.0641","0.0316","","0.1082","0.0757","0.1082","","","","","","0.9786","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076531","10.5793","0.0002","10.6046","0.0003","15.4375","0.0004","82.0374","0.0011","72.8897","0.0014","61.3733","0.0013","1452.92","0.07","200","","200","","","","","","","","local","8","P -1","-P 1","2","","","","- C52 H68 B2 Mo2 N12 O4 Rh2 Se2 -","- C52 H68 B2 Mo2 N12 O4 Rh2 Se2 -","- C52 H68 B2 Mo2 N12 O4 Rh2 Se2 -","1","0.5","","Hill, Anthony F.; McQueen, Caitlin M. A.","Novel Carbon Monochalcogenide Coordination Mode: [Rh2{μ-SeCMo(CO)2(Tp*)}2(η4-cod)2] (Tp* = hydrotris(3,5-dimethylpyrazol-1-yl)borate; cod =cyclo-octa-1,5-diene)","Organometallics","2012","31","6","2482","","10.1021/om3000086","","","0.71073","MoKα","","0.0451","0.0329","","0.0796","0.0743","0.0796","","","","","","0.9818","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076532","19.9052","0.0005","10.7519","0.0003","27.3135","0.0008","90","","107.388","0.0009","90","","5578.5","0.3","173.1","","173.1","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H37 Cl5 Mo N P2 -","- C20 H37 Cl5 Mo N P2 -","- C160 H296 Cl40 Mo8 N8 P16 -","8","1","","Arashiba, Kazuya; Sasaki, Kouitsu; Kuriyama, Shogo; Miyake, Yoshihiro; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Protonation of Molybdenum‒ and Tungsten‒Dinitrogen Complexes Bearing PNP-Type Pincer Ligands","Organometallics","2012","31","5","2035","","10.1021/om300011z","","","0.71075","MoKα","","","0.0508","","","","0.1259","","","","","","1.022","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076533","8.8589","0.0008","20.7314","0.0018","17.8396","0.0017","90","","106.435","0.003","90","","3142.5","0.5","173.1","","173.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H52 Mo N5 P3 -","- C26 H52 Mo N5 P3 -","- C104 H208 Mo4 N20 P12 -","4","1","","Arashiba, Kazuya; Sasaki, Kouitsu; Kuriyama, Shogo; Miyake, Yoshihiro; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Protonation of Molybdenum– and Tungsten–Dinitrogen Complexes Bearing PNP-Type Pincer Ligands","Organometallics","2012","31","5","2035","","10.1021/om300011z","","","0.71075","MoKα","","","0.033","","","","0.109","","","","","","1.002","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076534","29.2304","0.0008","14.9824","0.0004","19.7839","0.0005","90","","126.287","0.0007","90","","6983.8","0.3","173","","173","","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C27 H51 Cl3 N O P2 W -","- C27 H43 Cl3 N O P2 W -","- C216 H344 Cl24 N8 O8 P16 W8 -","8","2","","Arashiba, Kazuya; Sasaki, Kouitsu; Kuriyama, Shogo; Miyake, Yoshihiro; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Protonation of Molybdenum‒ and Tungsten‒Dinitrogen Complexes Bearing PNP-Type Pincer Ligands","Organometallics","2012","31","5","2035","","10.1021/om300011z","","","0.71075","MoKα","","","0.0316","","","","0.0785","","","","","","1.009","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076535","10.6999","0.0006","13.0508","0.0006","13.9197","0.0007","73.1991","0.0012","79.6971","0.0015","69.3292","0.0014","1734.6","0.15","296","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C31 H54 N5 P3 W -","- C31 H54 N5 P3 W -","- C62 H108 N10 P6 W2 -","2","1","","Arashiba, Kazuya; Sasaki, Kouitsu; Kuriyama, Shogo; Miyake, Yoshihiro; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Protonation of Molybdenum– and Tungsten–Dinitrogen Complexes Bearing PNP-Type Pincer Ligands","Organometallics","2012","31","5","2035","","10.1021/om300011z","","","0.71075","MoKα","","","0.0406","","","","0.0925","","","","","","1.017","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076536","17.33","0.003","10.0397","0.0016","22.406","0.004","90","","107.715","0.002","90","","3713.5","1.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H47 Cl2 Ge2 N4 P Si2 -","- C26 H47 Cl2 Ge2 N4 P Si2 -","- C104 H188 Cl8 Ge8 N16 P4 Si8 -","4","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0306","0.0273","","","0.0815","0.0834","","","","","","1.084","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076537","9.5087","0.001","10.5988","0.0011","15.3895","0.0015","75.362","0.002","78.652","0.002","70.747","0.001","1405.7","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H82 Cl2 N4 P2 Si8 Sn2 -","- C36 H82 Cl2 N4 P2 Si8 Sn2 -","- C36 H82 Cl2 N4 P2 Si8 Sn2 -","1","0.5","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0267","0.0248","","","0.0669","0.0685","","","","","","1.058","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076538","16.175","0.01","12.434","0.007","17.246","0.01","90","","108.827","0.009","90","","3283","3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H48 Cl2 N4 Si2 Sn2 -","- C20 H48 Cl2 N4 Si2 Sn2 -","- C80 H192 Cl8 N16 Si8 Sn8 -","4","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0494","0.0336","","","0.0975","0.1462","","","","","","1.1","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076539","9.01","0.001","11.5526","0.0013","17.337","0.002","89.039","0.002","78.051","0.002","67.828","0.002","1631.2","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H46 Cl Ge N2 P Si4 -","- C24 H46 Cl Ge N2 P Si4 -","- C48 H92 Cl2 Ge2 N4 P2 Si8 -","2","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus–Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0405","0.0342","","","0.0858","0.0922","","","","","","1.059","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076540","12.4363","0.0014","16.8886","0.0019","19.353","0.002","93.611","0.002","106.664","0.002","100.286","0.002","3803.2","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H57 Cl2 N4 P Si2 Sn2 -","- C24.192 H57.576 Cl2 N4 P Si2 Sn2 -","- C96.768 H230.304 Cl8 N16 P4 Si8 Sn8 -","4","2","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0367","0.0316","","","0.0811","0.0853","","","","","","1.036","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076541","16.782","0.003","18.699","0.003","11.7227","0.0019","90","","100.186","0.002","90","","3620.7","1","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H57 Cl2 Ge2 N4 P Si2 -","- C24 H57 Cl2 Ge2 N4 P Si2 -","- C96 H228 Cl8 Ge8 N16 P4 Si8 -","4","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus–Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0271","0.0238","","","0.0641","0.0659","","","","","","1.063","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076542","10.6676","0.0009","11.8453","0.001","12.1007","0.0011","77.3","0.001","89.967","0.001","76.158","0.001","1446.1","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H45 Cl2 Ge N2 P Si4 -","- C16 H45 Cl2 Ge N2 P Si4 -","- C32 H90 Cl4 Ge2 N4 P2 Si8 -","2","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus–Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0237","0.0226","","","0.0647","0.0655","","","","","","1.062","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076543","16.001","0.0014","9.052","0.0008","18.8509","0.0016","90","","110.288","0.001","90","","2561","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H42 Cl N2 P Si Sn -","- C18 H42 Cl N2 P Si Sn -","- C72 H168 Cl4 N8 P4 Si4 Sn4 -","4","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.027","0.0249","","","0.0659","0.0676","","","","","","1.05","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076544","11.2153","0.0012","11.8227","0.0013","18.439","0.002","90","","93.948","0.002","90","","2439.1","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H42 Cl Ge N2 P Si -","- C18 H42 Cl Ge N2 P Si -","- C72 H168 Cl4 Ge4 N8 P4 Si4 -","4","1","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus–Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0288","0.0256","","","0.0721","0.0742","","","","","","1.055","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076545","17.6548","0.0007","17.6548","0.0007","10.5683","0.0008","90","","90","","90","","3294.1","0.3","173","2","173","2","","","","","","","","7","P -4","P -4","81","","","","- C41 H98 Cl4 Ge4 N8 P2 Si4 -","- C41 H98 Cl4 Ge4 N8 P2 Si4 -","- C82 H196 Cl8 Ge8 N16 P4 Si8 -","2","0.5","","West, Joseph K.; Stahl, Lothar","Insertions of Cyclic and Acyclic Germanium and Tin Heterocarbenoids into Phosphorus‒Chlorine Bonds: Syntheses, Structures, and Reactivities","Organometallics","2012","31","5","2042","","10.1021/om3000168","","","0.71073","MoKα","","0.0232","0.0218","","","0.0593","0.06","","","","","","1.039","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076546","11.6228","0.0004","18.1284","0.0007","23.6578","0.0009","90","","90","","90","","4984.8","0.3","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H13 B F15 N -","- C27 H13 B F15 N -","- C216 H104 B8 F120 N8 -","8","2","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.0387","0.0315","","","0.0716","0.0758","","","","","","1.021","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076547","9.987","0.0005","10.673","0.0005","14.315","0.0007","71.935","0.002","80.851","0.002","81.259","0.002","1423.59","0.12","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H15 B Cl2 F15 N -","- C28 H15 B Cl2 F15 N -","- C56 H30 B2 Cl4 F30 N2 -","2","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0509","0.0468","","","0.1219","0.1257","","","","","","1.035","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076548","9.9101","0.0004","16.3709","0.0014","15.6368","0.001","90","","94.644","0.004","90","","2528.5","0.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H13 B F15 N -","- C26 H13 B F15 N -","- C104 H52 B4 F60 N4 -","4","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0732","0.0491","","","0.1102","0.1276","","","","","","1.015","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076549","10.1853","0.0003","13.3147","0.0008","21.7805","0.0007","86.615","0.004","73.671","0.003","68.525","0.003","2634.6","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H15 B F15 N -","- C27 H15 B F15 N -","- C108 H60 B4 F60 N4 -","4","2","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0675","0.0563","","","0.1427","0.1499","","","","","","1.061","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076550","9.3616","0.0018","11.479","0.002","15.046","0.003","73.474","0.009","85.102","0.009","67.335","0.006","1429.8","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H36 B2 Br F30 N2 -","- C58 H36 B2 Br F30 N2 -","- C58 H36 B2 Br F30 N2 -","1","0.5","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.1055","0.0604","","","0.144","0.1632","","","","","","1.081","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076551","14.309","0.003","12.16","0.002","15.471","0.003","90","","92.833","0.007","90","","2688.6","0.9","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H13 B F15 N O2 -","- C28 H13 B F15 N O2 -","- C112 H52 B4 F60 N4 O8 -","4","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.0743","0.0447","","","0.1015","0.1154","","","","","","1.016","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076552","7.5203","0.0003","18.6531","0.0008","19.9816","0.001","90","","90","","90","","2803","0.2","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H15 B F15 N O2 -","- C28 H15 B F15 N O2 -","- C112 H60 B4 F60 N4 O8 -","4","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0704","0.043","","","0.0874","0.1019","","","","","","1.035","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076553","11.2336","0.0004","14.9889","0.0006","44.3937","0.0016","90","","90.618","0.002","90","","7474.5","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37.5 H25 B Cl F15 N2 O2 -","- C37.5 H25 B Cl F15 N2 O2 -","- C300 H200 B8 Cl8 F120 N16 O16 -","8","2","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.0681","0.0526","","","0.1172","0.1266","","","","","","1.051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4076554","11.8169","0.0009","14.2528","0.001","25.8313","0.0018","92.291","0.004","101.983","0.004","94.629","0.004","4234.7","0.5","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H38 B Cl2 F15 N2 O3 -","- C40 H38 B Cl2 F15 N2 O3 -","- C160 H152 B4 Cl8 F60 N8 O12 -","4","2","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.1432","0.0847","","","0.2305","0.2712","","","","","","1.03","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076555","15.0642","0.0017","12.337","0.0014","21.279","0.002","90","","109.498","0.007","90","","3727.9","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H35 B F15 N2 O2 -","- C37 H35 B F15 N2 O2 -","- C148 H140 B4 F60 N8 O8 -","4","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.2101","0.0679","","","0.159","0.2212","","","","","","0.964","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076556","10.098","0.0008","11.9201","0.0009","15.5418","0.0013","88.808","0.004","80.396","0.005","69.131","0.004","1722","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H27 B F15 N O2 Si -","- C34 H27 B F15 N O2 Si -","- C68 H54 B2 F30 N2 O4 Si2 -","2","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","0.71073","MoKα","","0.0785","0.0423","","","0.0911","0.1082","","","","","","1.012","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076557","13.2426","0.0003","13.7868","0.0003","18.2798","0.0005","111.59","0.002","99.707","0.002","101.426","0.001","2933.02","0.14","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C29.5 H18 B Cl F15 N -","- C29.5 H18 B Cl F15 N -","- C118 H72 B4 Cl4 F60 N4 -","4","2","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0635","0.0484","","","0.1125","0.124","","","","","","1.051","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076558","10.3487","0.0003","13.2156","0.0008","13.9427","0.0007","97.316","0.003","107.85","0.005","109.846","0.003","1649.26","0.16","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C35.5 H25 B F15 N -","- C35.5 H25 B F15 N -","- C71 H50 B2 F30 N2 -","2","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0645","0.0577","","","0.168","0.1752","","","","","","1.045","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076559","10.0966","0.0004","10.4671","0.0006","16.6994","0.0005","73.407","0.004","73.953","0.002","72.449","0.006","1577.24","0.13","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H23 B F15 N -","- C33 H23 B F15 N -","- C66 H46 B2 F30 N2 -","2","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0602","0.0532","","","0.1436","0.1509","","","","","","1.015","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076560","9.5086","0.0006","11.9158","0.0007","15.6879","0.001","94.247","0.005","97.456","0.004","106.783","0.003","1675.69","0.18","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H23 B Cl2 F15 N -","- C33 H23 B Cl2 F15 N -","- C66 H46 B2 Cl4 F30 N2 -","2","1","","Voss, Tanja; Mahdi, Tayseer; Otten, Edwin; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Frustrated Lewis Pair Behavior of Intermolecular Amine/B(C6F5)3Pairs","Organometallics","2012","31","6","2367","","10.1021/om300017u","","","1.54178","CuKα","","0.0855","0.0681","","","0.1751","0.192","","","","","","1.01","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076561","10.4396","0.0018","11.605","0.002","13.574","0.002","91.814","0.003","102.502","0.003","113.468","0.003","1459.9","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H29 Co O4 -","- C37 H29 Co O4 -","- C74 H58 Co2 O8 -","2","1","","Singh, Nem; Elias, Anil J.","Cyclopentadienyl 1,2- and 1,3-Disubstituted Cobalt Sandwich Compounds {η5-[MeOC(O)]2C5H3} Co(η4-C4Ph4): Precursors for Sterically Hindered Bidentate Chiral and Achiral Ligands","Organometallics","2012","31","5","2059","","10.1021/om300027c","","","0.71073","MoKα","","0.0883","0.0758","","","0.1605","0.1667","","","","","","1.199","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076562","8.1315","0.0012","20.642","0.003","17.443","0.003","90","","95.169","0.003","90","","2915.9","0.8","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H29 Co O4 -","- C37 H29 Co O4 -","- C148 H116 Co4 O16 -","4","1","","Singh, Nem; Elias, Anil J.","Cyclopentadienyl 1,2- and 1,3-Disubstituted Cobalt Sandwich Compounds {η5-[MeOC(O)]2C5H3} Co(η4-C4Ph4): Precursors for Sterically Hindered Bidentate Chiral and Achiral Ligands","Organometallics","2012","31","5","2059","","10.1021/om300027c","","","0.71073","MoKα","","0.074","0.0704","","","0.1435","0.1454","","","","","","1.317","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076563","10.351","0.0014","23.164","0.003","10.9642","0.0015","90","","93.506","0.003","90","","2624","0.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C35 H25 Co O4 -","- C35 H25 Co O4 -","- C140 H100 Co4 O16 -","4","1","","Singh, Nem; Elias, Anil J.","Cyclopentadienyl 1,2- and 1,3-Disubstituted Cobalt Sandwich Compounds {η5-[MeOC(O)]2C5H3} Co(η4-C4Ph4): Precursors for Sterically Hindered Bidentate Chiral and Achiral Ligands","Organometallics","2012","31","5","2059","","10.1021/om300027c","","","0.71073","MoKα","","0.0779","0.0685","","","0.1305","0.1345","","","","","","1.255","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076564","11.079","0.003","12.484","0.003","13.7","0.003","116.292","0.004","90.592","0.005","103.413","0.005","1638.5","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H31 Co Fe O2 -","- C45 H31 Co Fe O2 -","- C90 H62 Co2 Fe2 O4 -","2","1","","Singh, Nem; Elias, Anil J.","Cyclopentadienyl 1,2- and 1,3-Disubstituted Cobalt Sandwich Compounds {η5-[MeOC(O)]2C5H3} Co(η4-C4Ph4): Precursors for Sterically Hindered Bidentate Chiral and Achiral Ligands","Organometallics","2012","31","5","2059","","10.1021/om300027c","","","0.71073","MoKα","","0.1041","0.0635","","","0.1278","0.1414","","","","","","1.018","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076565","13.9582","0.0015","15.3057","0.0017","17.0851","0.0019","90","","90","","90","","3650.1","0.7","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C45 H43 Co N2 O2 -","- C45 H43 Co N2 O2 -","- C180 H172 Co4 N8 O8 -","4","1","","Singh, Nem; Elias, Anil J.","Cyclopentadienyl 1,2- and 1,3-Disubstituted Cobalt Sandwich Compounds {η5-[MeOC(O)]2C5H3} Co(η4-C4Ph4): Precursors for Sterically Hindered Bidentate Chiral and Achiral Ligands","Organometallics","2012","31","5","2059","","10.1021/om300027c","","","0.71073","MoKα","","0.0456","0.0435","","","0.0998","0.1009","","","","","","1.184","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4076566","10.9466","0.0004","12.2758","0.0004","21.0419","0.0008","76.998","0.003","76.763","0.003","81.982","0.003","2670.32","0.17","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C58 H51 F7 O5 P2 Pd S -","- C58 H51 F7 O5 P2 Pd S -","- C116 H102 F14 O10 P4 Pd2 S2 -","2","1","","Troshin, Konstantin; Mayer, Peter; Mayr, Herbert","How Does Palladium Coordination Affect the Electrophilicities of Allyl Cations? Development of a Robust Kinetic Method for Following Reactions of [(η3-Diarylallyl)Pd(PPh3)2]+with Nucleophiles","Organometallics","2012","31","6","2416","","10.1021/om3000357","","","0.71073","MoKα","","0.059","0.0369","","","0.0673","0.0709","","","","","","0.891","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076567","8.069","0.0003","10.113","0.0004","11.98","0.0004","81.033","0.002","87.225","0.002","68.423","0.002","897.93","0.06","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H13 O P S2 -","- C24 H13 O P S2 -","- C48 H26 O2 P2 S4 -","2","1","","Chua, Chris Jansen; Ren, Yi; Baumgartner, Thomas","Structure–Property Studies of Bichromophoric, PAH-Functionalized Dithieno[3,2-b:2′,3′-d]phospholes","Organometallics","2012","31","6","2425","","10.1021/om3000407","","x-ray","0.71073","MoKα","","0.056","0.0474","","","0.1348","0.1467","","","","","","1.218","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076568","9.949","0.0002","11.736","0.0003","14.753","0.0004","71.303","0.001","74.483","0.002","65.75","0.002","1469.18","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H29 O P S2 Si2 -","- C30 H29 O P S2 Si2 -","- C60 H58 O2 P2 S4 Si4 -","2","1","","Chua, Chris Jansen; Ren, Yi; Baumgartner, Thomas","Structure–Property Studies of Bichromophoric, PAH-Functionalized Dithieno[3,2-b:2′,3′-d]phospholes","Organometallics","2012","31","6","2425","","10.1021/om3000407","","x-ray","0.71073","MoKα","","0.0731","0.054","","","0.1331","0.1565","","","","","","1.138","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076569","9.0587","0.0008","9.8346","0.0009","14.3299","0.0013","96.37","0.001","95.25","0.001","112.138","0.001","1162.83","0.18","123","2","123","2","","","","","","","","5","P -1","-P 1","2","11168a","","","- C28 H27 Cr O2 P -","- C28 H27 Cr O2 P -","- C56 H54 Cr2 O4 P2 -","2","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0343","0.0293","","","0.0759","0.0796","","","","","","1.043","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076570","9.0261","0.001","9.9033","0.0011","14.4336","0.0015","97.124","0.001","94.271","0.001","111.755","0.001","1178.9","0.2","123","2","123","2","","","","","","","","5","P -1","-P 1","2","11169a","","","- C28 H27 O2 P W -","- C28 H27 O2 P W -","- C56 H54 O4 P2 W2 -","2","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0195","0.0177","","","0.0396","0.0403","","","","","","1.024","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076571","12.1099","0.001","10.3912","0.0009","15.3794","0.0013","90","","93.047","0.001","90","","1932.6","0.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","11181a","","","- C21 H18 Cr I O2 P -","- C21 H18 Cr I O2 P -","- C84 H72 Cr4 I4 O8 P4 -","4","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0262","0.0229","","","0.0596","0.0617","","","","","","1.064","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076572","14.0313","0.0012","15.0391","0.0013","18.2127","0.0016","90","","90","","90","","3843.2","0.6","123","2","123","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","11167b","","","- C21 H18 Cl Mo O2 P -","- C21 H18 Cl Mo O2 P -","- C168 H144 Cl8 Mo8 O16 P8 -","8","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0348","0.0258","","","0.0589","0.0635","","","","","","1.018","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076573","10.5066","0.0006","10.8751","0.0006","17.7984","0.001","79.479","0.001","83.218","0.001","77.973","0.001","1948.79","0.19","173","2","173","2","","","","","","","","6","P -1","-P 1","2","06217","","","- C21 H18 Br Mo O2 P -","- C21 H18 Br Mo O2 P -","- C84 H72 Br4 Mo4 O8 P4 -","4","2","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0389","0.0285","","","0.057","0.0602","","","","","","1.022","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076574","12.1961","0.0011","10.5867","0.001","15.4413","0.0014","90","","92.419","0.001","90","","1991.9","0.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","11136a","","","- C21 H18 I Mo O2 P -","- C21 H18 I Mo O2 P -","- C84 H72 I4 Mo4 O8 P4 -","4","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.062","0.0347","","","0.0581","0.0663","","","","","","1.008","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076575","24.388","0.002","24.388","0.002","13.1383","0.0012","90","","90","","90","","7814.3","1.2","173","2","173","2","","","","","","","","6","I 41 c d","I 4bw -2c","110","11105y","","","- C21 H18 Br O2 P W -","- C21 H18 Br O2 P W -","- C336 H288 Br16 O32 P16 W16 -","16","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0444","0.034","","","0.0674","0.0712","","","","","","1.003","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076576","10.474","0.002","23.816","0.005","13.435","0.003","90","","90.636","0.002","90","","3351.1","1.2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","11034b","","","- C33 H42 Cr K O8 P -","- C33 H42 Cr K O8 P -","- C132 H168 Cr4 K4 O32 P4 -","4","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0404","0.0315","","","0.0781","0.0836","","","","","","1.036","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076577","10.5873","0.0008","23.9468","0.0018","13.4106","0.001","90","","91.883","0.001","90","","3398.2","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","07190","","","- C33 H42 K Mo O8 P -","- C33 H42 K Mo O8 P -","- C132 H168 K4 Mo4 O32 P4 -","4","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.0437","0.0286","","","0.0607","0.0649","","","","","","1.024","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076578","10.5617","0.0012","23.936","0.003","13.4165","0.0015","90","","91.754","0.002","90","","3390.2","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","11102a","","","- C33 H42 K O8 P W -","- C33 H42 K O8 P W -","- C132 H168 K4 O32 P4 W4 -","4","1","","Fischer, Paul J.; Neary, Michelle C.; Avena, Laura; Sullivan, Kevin P.; Hackbarth, Kent C.","Dicarbonyl{[2-(diphenylphosphino)ethyl]cyclopentadienyl} Group VI Metal Hydrides, Halides, and Anions: Precursors for Olefin Epoxidation Catalysts","Organometallics","2012","31","6","2437","","10.1021/om300057n","","","0.71073","MoKα","","0.051","0.0315","","","0.0538","0.0583","","","","","","1.019","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076579","11.8808","0.0018","5.8206","0.0009","19.977","0.003","90","","94.089","0.003","90","","1378","0.4","153","1","153","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H50 N4 -","- C26 H50 N4 -","- C52 H100 N8 -","2","0.5","","Krupski, Sergei; Dickschat, Julia V.; Hepp, Alexander; Pape, Tania; Hahn, F. Ekkehardt","Synthesis and Characterization of Rigid Ditopic N-Heterocyclic Benzobisgermylenes and -stannylenes","Organometallics","2012","31","5","2078","","10.1021/om3000604","","","0.71073","MoKα","","0.0857","0.0543","","","0.1355","0.1531","","","","","","1.031","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076580","16.9241","0.0017","5.9332","0.0006","22.483","0.002","90","","102.826","0.002","90","","2201.3","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H34 Ge2 N4 -","- C20 H34 Ge2 N4 -","- C80 H136 Ge8 N16 -","4","1","","Krupski, Sergei; Dickschat, Julia V.; Hepp, Alexander; Pape, Tania; Hahn, F. Ekkehardt","Synthesis and Characterization of Rigid Ditopic N-Heterocyclic Benzobisgermylenes and -stannylenes","Organometallics","2012","31","5","2078","","10.1021/om3000604","","","0.71073","MoKα","","0.0765","0.0408","","","0.077","0.0894","","","","","","0.98","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076581","9.4197","0.0007","11.3455","0.0009","12.6917","0.001","80.774","0.001","81.371","0.001","68.643","0.001","1240.68","0.17","153","1","153","1","","","","","","","","5","P -1","-P 1","2","","","","- C38 H82 N6 Si4 Sn2 -","- C38 H82 N6 Si4 Sn2 -","- C38 H82 N6 Si4 Sn2 -","1","0.5","","Krupski, Sergei; Dickschat, Julia V.; Hepp, Alexander; Pape, Tania; Hahn, F. Ekkehardt","Synthesis and Characterization of Rigid Ditopic N-Heterocyclic Benzobisgermylenes and -stannylenes","Organometallics","2012","31","5","2078","","10.1021/om3000604","","","0.71073","MoKα","","0.0306","0.026","","","0.0615","0.0636","","","","","","1.062","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076582","13.1239","0.0005","11.0728","0.0004","16.2589","0.0007","90","","92.188","0.001","90","","2360.99","0.16","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H74 N6 Si4 Sn2 -","- C34 H74 N6 Si4 Sn2 -","- C68 H148 N12 Si8 Sn4 -","2","0.5","","Krupski, Sergei; Dickschat, Julia V.; Hepp, Alexander; Pape, Tania; Hahn, F. Ekkehardt","Synthesis and Characterization of Rigid Ditopic N-Heterocyclic Benzobisgermylenes and -stannylenes","Organometallics","2012","31","5","2078","","10.1021/om3000604","","","0.71073","MoKα","","0.0445","0.03","","","0.0602","0.0656","","","","","","1.029","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076583","16.1816","0.0011","20.1417","0.0014","15.0553","0.0011","90","","99.085","0.003","90","","4845.3","0.6","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H73 Fe2 N P2 -","- C56 H73 Fe2 N P2 -","- C224 H292 Fe8 N4 P8 -","4","0.5","","Tian, Rongqiang; Ng, Yongxiang; Ganguly, Rakesh; Mathey, François","A New Type of Phosphaferrocene‒Pyrrole‒Phosphaferrocene P-N-P Pincer Ligand","Organometallics","2012","31","6","2486","","10.1021/om300061d","","","0.71073","MoKα","","0.1234","0.0683","","","0.1775","0.2137","","","","","","1.049","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076584","14.229","0.003","18.247","0.004","18.508","0.005","94.567","0.008","104.179","0.006","90.188","0.01","4642.9","1.9","103","2","103","2","","","","","","","","7","P -1","-P 1","2","","","","- C52.75 H60 Fe2 N O P2 Rh -","- C52.75 H60 Fe2 N O P2 Rh -","- C211 H240 Fe8 N4 O4 P8 Rh4 -","4","2","","Tian, Rongqiang; Ng, Yongxiang; Ganguly, Rakesh; Mathey, François","A New Type of Phosphaferrocene–Pyrrole–Phosphaferrocene P-N-P Pincer Ligand","Organometallics","2012","31","6","2486","","10.1021/om300061d","","","0.71073","MoKα","","0.1119","0.0568","","","0.1341","0.185","","","","","","1.057","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076585","8.8154","0.0003","12.905","0.0006","19.3331","0.0005","90","","90","","90","","2199.39","0.14","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H6 B F15 -","- C23 H6 B F15 -","- C92 H24 B4 F60 -","4","1","","Feldmann, Andreas; Iida, Azusa; Fröhlich, Roland; Yamaguchi, Shigehiro; Kehr, Gerald; Erker, Gerhard","Preparation of Dihydroborole Derivatives by a Simple 1,1-Carboboration Route","Organometallics","2012","31","6","2445","","10.1021/om300065m","","","1.54178","CuKα","","0.0335","0.0317","","","0.0854","0.0871","","","","","","1.045","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076586","9.9747","0.0008","12.246","0.0013","16.1369","0.0017","87.714","0.012","75.686","0.009","72.078","0.008","1815.9","0.3","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H35 B F15 P -","- C35 H35 B F15 P -","- C70 H70 B2 F30 P2 -","2","1","","Feldmann, Andreas; Iida, Azusa; Fröhlich, Roland; Yamaguchi, Shigehiro; Kehr, Gerald; Erker, Gerhard","Preparation of Dihydroborole Derivatives by a Simple 1,1-Carboboration Route","Organometallics","2012","31","6","2445","","10.1021/om300065m","","","1.54178","CuKα","","0.0806","0.076","","","0.2216","0.2288","","","","","","1.095","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076587","13.1586","0.0005","10.5956","0.0003","21.6978","0.0009","90","","94.76","0.004","90","","3014.74","0.19","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H19 B F15 N -","- C31 H19 B F15 N -","- C124 H76 B4 F60 N4 -","4","1","","Feldmann, Andreas; Iida, Azusa; Fröhlich, Roland; Yamaguchi, Shigehiro; Kehr, Gerald; Erker, Gerhard","Preparation of Dihydroborole Derivatives by a Simple 1,1-Carboboration Route","Organometallics","2012","31","6","2445","","10.1021/om300065m","","","1.54178","CuKα","","0.0499","0.0441","","","0.1151","0.1207","","","","","","1.059","","","","has coordinates","301830","2025-08-20","13:17:24",""
"4076588","15.0289","0.0009","8.1008","0.0002","19.3668","0.0007","90","","90.147","0.004","90","","2357.82","0.17","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H10 B F15 -","- C26 H10 B F15 -","- C104 H40 B4 F60 -","4","2","","Feldmann, Andreas; Iida, Azusa; Fröhlich, Roland; Yamaguchi, Shigehiro; Kehr, Gerald; Erker, Gerhard","Preparation of Dihydroborole Derivatives by a Simple 1,1-Carboboration Route","Organometallics","2012","31","6","2445","","10.1021/om300065m","","","1.54178","CuKα","","0.0484","0.0474","","","0.1204","0.1214","","","","","","1.045","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076589","7.4428","0.0002","12.5739","0.001","16.1379","0.0005","92.161","0.003","102.917","0.002","100.476","0.004","1442.67","0.13","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C28.5 H20 B F15 Si -","- C28.5 H20 B F15 Si -","- C57 H40 B2 F30 Si2 -","2","1","","Feldmann, Andreas; Iida, Azusa; Fröhlich, Roland; Yamaguchi, Shigehiro; Kehr, Gerald; Erker, Gerhard","Preparation of Dihydroborole Derivatives by a Simple 1,1-Carboboration Route","Organometallics","2012","31","6","2445","","10.1021/om300065m","","","1.54178","CuKα","","0.0419","0.0409","","","0.1133","0.1144","","","","","","1.054","","","","has coordinates,has disorder","301830","2025-08-20","13:17:24",""
"4076590","13.7434","0.0011","16.1755","0.0013","16.5521","0.0014","91.446","0.001","97.41","0.001","103.874","0.001","3536.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","Ni2Lig2","","","- C19.5 H26.25 N1.5 Ni0.75 O0.75 -","- C19.5 H21 N3 Ni0.75 O0.75 -","- C156 H168 N24 Ni6 O6 -","8","4","","Bheemaraju, Amarnath; Lord, Richard L.; Müller, Peter; Groysman, Stanislav","Difference in the Reactivities of H- and Me-Substituted Dinucleating Bis(iminopyridine) Ligands with Nickel(0)","Organometallics","2012","31","6","2120","","10.1021/om300067z","","","0.71073","MoKα","","0.0646","0.048","","","0.1221","0.1334","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4076591","49.6456","0.0014","9.7578","0.0002","20.2349","0.0006","90","","105.114","0.003","90","","9463.4","0.5","150","2","150","0.3","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[K-(18-crown-6)]2{H[P7C(NiPr)2]}","","- C31 H63 K2 N2 O12 P7 -","- C31 H63 K2 N2 O12 P7 -","- C248 H504 K16 N16 O96 P56 -","8","1","","Turbervill, Robert S. P.; Goicoechea, Jose M.","Hydrophosphination of Carbodiimides Using Protic Heptaphosphide Cages: A Unique Effect of the Bimodal Activity of Protonated Group 15 Zintl Ions","Organometallics","2012","31","6","2452","","10.1021/om300072z","","","1.54178","CuKα","","0.0527","0.0445","","","0.1141","0.1229","","","","","","1.035","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076592","20.548","0.0005","16.9255","0.0003","15.8004","0.0003","90","","90","","90","","5495.1","0.2","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","[K(2,2,2-crypt)][HPC(NHDipp)(NDipp)]","","- C43 H72 K N4 O6 P7 -","- C43 H72 K N4 O6 P7 -","- C172 H288 K4 N16 O24 P28 -","4","1","","Turbervill, Robert S. P.; Goicoechea, Jose M.","Hydrophosphination of Carbodiimides Using Protic Heptaphosphide Cages: A Unique Effect of the Bimodal Activity of Protonated Group 15 Zintl Ions","Organometallics","2012","31","6","2452","","10.1021/om300072z","","","1.5418","CuKα","","0.068","0.0483","","","0.1171","0.1315","","","","","","1.071","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076593","15.6647","0.0003","15.127","0.0003","17.1338","0.0004","90","","91.22","0.002","90","","4059.1","0.15","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","[K(2,2,2-crypt)]{P[C(NHDipp)(NDipp)]2}*THF","","- C72 H114 K N6 O7 P7 -","- C72 H114 K N6 O7 P7 -","- C144 H228 K2 N12 O14 P14 -","2","1","","Turbervill, Robert S. P.; Goicoechea, Jose M.","Hydrophosphination of Carbodiimides Using Protic Heptaphosphide Cages: A Unique Effect of the Bimodal Activity of Protonated Group 15 Zintl Ions","Organometallics","2012","31","6","2452","","10.1021/om300072z","","","1.5418","CuKα","","0.0749","0.0629","","","0.1706","0.1835","","","","","","1.018","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076594","15.9418","0.0002","16.7687","0.0002","26.4606","0.0004","90","","90","","90","","7073.53","0.16","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","[K(2,2,2-crypt)]{P[C(NHDipp)(NDipp)][C(NHiPr)(NiPr)]}*hex","","- C56 H100 K N6 O6 P7 -","- C56 H100 K N6 O6 P7 -","- C224 H400 K4 N24 O24 P28 -","4","1","","Turbervill, Robert S. P.; Goicoechea, Jose M.","Hydrophosphination of Carbodiimides Using Protic Heptaphosphide Cages: A Unique Effect of the Bimodal Activity of Protonated Group 15 Zintl Ions","Organometallics","2012","31","6","2452","","10.1021/om300072z","","","1.54178","CuKα","","0.0729","0.0631","","","0.1699","0.1799","","","","","","1.034","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4076595","16.0447","0.0002","26.4964","0.0003","16.9173","0.0001","90","","91.488","0.001","90","","7189.57","0.13","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[K(2,2,2-crypt)]{P[C(NHDipp)(NDipp)][C(NHCy)(NCy)]}*0.65THF*0.35hex","","- C60.69 H104.08 K N6 O6.65 P7 -","- C60.6922 H104.077 K N6 O6.6539 P7 -","- C242.769 H416.306 K4 N24 O26.6156 P28 -","4","1","","Turbervill, Robert S. P.; Goicoechea, Jose M.","Hydrophosphination of Carbodiimides Using Protic Heptaphosphide Cages: A Unique Effect of the Bimodal Activity of Protonated Group 15 Zintl Ions","Organometallics","2012","31","6","2452","","10.1021/om300072z","","","1.54178","CuKα","","0.0498","0.0404","","","0.1037","0.111","","","","","","1.023","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076596","13.386","0.0003","14.1535","0.0004","20.608","0.0007","90","","94.0228","0.0009","90","","3894.75","0.19","173","","","","","","","","","","LOC ETH Zurich","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H36 Al F15 Zr -","- C40 H36 Al F15 Zr -","- C160 H144 Al4 F60 Zr4 -","4","1","","Mathis, Déborah; Couzijn, Erik P. A.; Chen, Peter","Correction to Structure, Dynamics, and Polymerization Activity of Zirconocenium Ion Pairs Generated with Boron-C6F5Compounds and Al2R6","Organometallics","2012","31","5","2117","","10.1021/om300090p","","","0.71073","MoKα","","0.1271","0.0987","","","0.2683","0.2891","","","","","","1.816","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4076597","9.0305","0.0003","14.7984","0.0003","23.3313","0.0008","90","","94.628","0.002","90","","3107.76","0.16","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H30 Cl6 Fe N4 -","- C25 H30 Cl6 Fe N4 -","- C100 H120 Cl24 Fe4 N16 -","4","1","","Al Thagfi, Jameel; Lavoie, Gino G.","Synthesis, Characterization, and Ethylene Polymerization Studies of Chromium, Iron, and Cobalt Complexes Containing 1,3-Bis(imino)-N-Heterocyclic Carbene Ligands","Organometallics","2012","31","6","2463","","10.1021/om3001058","","","0.71073","MoKα","","0.1132","0.0552","","","0.1351","0.1671","","","","","","1.03","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076598","9.0052","0.0003","14.7348","0.0003","23.3276","0.0007","90","","94.697","0.001","90","","3084.94","0.15","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H30 Cl6 Co N4 -","- C25 H30 Cl6 Co N4 -","- C100 H120 Cl24 Co4 N16 -","4","1","","Al Thagfi, Jameel; Lavoie, Gino G.","Synthesis, Characterization, and Ethylene Polymerization Studies of Chromium, Iron, and Cobalt Complexes Containing 1,3-Bis(imino)-N-Heterocyclic Carbene Ligands","Organometallics","2012","31","6","2463","","10.1021/om3001058","","","0.71073","MoKα","","0.0972","0.0567","","","0.1465","0.1736","","","","","","1.055","","","","has coordinates","178654","2020-10-21","18:00:00",""
"4076599","15.3436","0.0008","17.5786","0.001","17.7453","0.001","64.999","0.002","82.728","0.003","73.661","0.003","4162.4","0.4","150","2","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C43 H50 Cl3 Cr N4 O2 -","- C43 H50 Cl3 Cr N4 O2 -","- C172 H200 Cl12 Cr4 N16 O8 -","4","2","","Al Thagfi, Jameel; Lavoie, Gino G.","Synthesis, Characterization, and Ethylene Polymerization Studies of Chromium, Iron, and Cobalt Complexes Containing 1,3-Bis(imino)-N-Heterocyclic Carbene Ligands","Organometallics","2012","31","6","2463","","10.1021/om3001058","","","0.71073","MoKα","","0.1774","0.0707","","","0.1558","0.2005","","","","","","1.013","","","","has coordinates,has disorder","178654","2020-10-21","18:00:00",""
"4076600","11.4684","0.0007","13.654","0.0009","16.2059","0.0009","90","","108.816","0.003","90","","2402.1","0.3","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 F6 N3 O P Ru -","- C22 H28 F6 N3 O P Ru -","- C88 H112 F24 N12 O4 P4 Ru4 -","4","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Factors Favoring Efficient Bifunctional Catalysis. Study of a Ruthenium(II) Hydrogenation Catalyst Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2137","","10.1021/om300108p","","","0.71073","MoKα","","0.0872","0.0522","","","0.1094","0.1248","","","","","","1.024","","","","has coordinates,has disorder","178655","2020-10-21","18:00:00",""
"4076601","10.3534","0.0003","15.8749","0.0007","17.9498","0.0009","90","","90.204","0.003","90","","2950.2","0.2","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H33 F6 N O P2 Ru -","- C30 H33 F6 N O P2 Ru -","- C120 H132 F24 N4 O4 P8 Ru4 -","4","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Factors Favoring Efficient Bifunctional Catalysis. Study of a Ruthenium(II) Hydrogenation Catalyst Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2137","","10.1021/om300108p","","","0.71073","MoKα","","0.1282","0.0586","","","0.1243","0.1524","","","","","","1.02","","","","has coordinates,has disorder","178655","2020-10-21","18:00:00",""
"4077834","8.9374","0.0007","12.0045","0.0009","16.5567","0.0013","74.131","0.009","82.93","0.009","68.19","0.008","1585.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H49 Br2 Fe Na O4 -","- C25 H49 Br2 Fe Na O4 -","- C50 H98 Br4 Fe2 Na2 O8 -","2","1","","Vollmer, Guy Y.; Wallasch, Mark W.; Saurenz, Dirk; Wolmershäuser, Gotthelf; Sitzmann, Helmut","Correction to Benzylidyne Bridges from Diphenylacetylene and a Methylidyne Bridge from Methylmagnesium Chloride","Organometallics","2012","31","8","3455","","10.1021/om200383x","","","0.71073","MoKα","","0.0709","0.0412","","","0.0882","0.0956","","","","","","0.864","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077835","11.4246","0.0009","17.1036","0.001","11.7811","0.0009","90","","113.143","0.009","90","","2116.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C48 H68 Fe2 -","- C48 H68 Fe2 -","- C96 H136 Fe4 -","2","0.5","","Vollmer, Guy Y.; Wallasch, Mark W.; Saurenz, Dirk; Wolmershäuser, Gotthelf; Sitzmann, Helmut","Correction to Benzylidyne Bridges from Diphenylacetylene and a Methylidyne Bridge from Methylmagnesium Chloride","Organometallics","2012","31","8","3455","","10.1021/om200383x","","","0.71073","MoKα","","0.039","0.0285","","","0.0709","0.0736","","","","","","0.957","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077836","17.3057","0.001","14.5628","0.0009","12.9205","0.0005","90","","104.184","0.003","90","","3156.9","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32.5 H41 Br2 Cl N4 -","- C32.5 H41 Br2 Cl N4 -","- C130 H164 Br8 Cl4 N16 -","4","1","","Zuo, Weiwei; Braunstein, Pierre","N-Heterocyclic Dicarbene Iridium(III) Pincer Complexes Featuring Mixed NHC/Abnormal NHC Ligands and Their Applications in the Transfer Dehydrogenation of Cyclooctane","Organometallics","2012","31","7","2606","","10.1021/om200444q","","x-ray","0.71073","MoKα","","0.0785","0.0492","","","0.1229","0.1316","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077837","8.865","0.006","14.884","0.007","15.122","0.007","92.39","0.03","100.23","0.04","101.12","0.04","1920.7","1.9","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H40 I2 Ir N5 -","- C34 H40 I2 Ir N5 -","- C68 H80 I4 Ir2 N10 -","2","1","","Zuo, Weiwei; Braunstein, Pierre","N-Heterocyclic Dicarbene Iridium(III) Pincer Complexes Featuring Mixed NHC/Abnormal NHC Ligands and Their Applications in the Transfer Dehydrogenation of Cyclooctane","Organometallics","2012","31","7","2606","","10.1021/om200444q","","x-ray","0.71073","MoKα","","0.1125","0.0527","","","0.1425","0.1629","","","","","","0.976","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077838","19.1978","0.0013","11.6425","0.0008","15.7377","0.0011","90","","122.093","0.001","90","","2980","0.4","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C25 H54 B Cl O3 Os P2 -","- C25 H54 B Cl O3 Os P2 -","- C100 H216 B4 Cl4 O12 Os4 P8 -","4","0.5","","Esteruelas, Miguel A.; López, Ana M.; Mora, Malka; Oñate, Enrique","Reactions of Osmium‒Pinacolboryl Complexes: Preparation of the First Vinylideneboronate Esters","Organometallics","2012","31","8","2965","","10.1021/om200485k","","","0.71073","MoKα","","0.034","0.0268","","","0.0516","0.0532","","","","","","0.925","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077839","11.5504","0.0005","23.2329","0.001","13.16","0.0006","90","","98.803","0.001","90","","3489.9","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H59 B O3 Os P2 -","- C33 H59 B O3 Os P2 -","- C132 H236 B4 O12 Os4 P8 -","4","1","","Esteruelas, Miguel A.; López, Ana M.; Mora, Malka; Oñate, Enrique","Reactions of Osmium‒Pinacolboryl Complexes: Preparation of the First Vinylideneboronate Esters","Organometallics","2012","31","8","2965","","10.1021/om200485k","","","0.71073","MoKα","","0.0273","0.021","","","0.048","0.0505","","","","","","1.035","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077840","11.0486","0.0006","24.2722","0.0014","18.719","0.0011","90","","90.188","0.001","90","","5019.9","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H83 B O4 Os P2 -","- C52 H83 B O4 Os P2 -","- C208 H332 B4 O16 Os4 P8 -","4","1","","Esteruelas, Miguel A.; López, Ana M.; Mora, Malka; Oñate, Enrique","Reactions of Osmium‒Pinacolboryl Complexes: Preparation of the First Vinylideneboronate Esters","Organometallics","2012","31","8","2965","","10.1021/om200485k","","","0.71073","MoKα","","0.0494","0.0339","","","0.0786","0.0823","","","","","","0.96","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077841","9.8002","0.0002","19.5809","0.0005","20.0382","0.0005","94.331","0.002","94.5328","0.0019","93.6782","0.0019","3812.77","0.16","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H32.25 Cl3.5 N3.25 O0.5 P Pd Pt -","- C36 H31.25 Cl3.5 N3.25 O0.5 P Pd Pt -","- C144 H125 Cl14 N13 O2 P4 Pd4 Pt4 -","4","2","","Petretto, Giacomo L.; Rourke, Jonathan P.; Maidich, Luca; Stoccoro, Sergio; Cinellu, Maria Agostina; Minghetti, Giovanni; Clarkson, Guy J.; Zucca, Antonio","Heterobimetallic Rollover Derivatives","Organometallics","2012","31","8","2971","","10.1021/om200660a","","","0.71073","MoKα","","0.1064","0.0895","","","0.19","0.198","","","","","","1.166","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077842","24.237","0.003","12.4207","0.0017","9.0234","0.0012","90","","105.478","0.007","90","","2617.9","0.6","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C21 H15 B10 Co F14 -","- C21 H15 B10 Co F14 -","- C84 H60 B40 Co4 F56 -","4","1","","Ward, Jas S.; Tricas, Hugo; Scott, Greig; Ellis, David; Rosair, Georgina M.; Welch, Alan J.","Facile Isomerization and Unprecedented Decarbonation of Metallacarboranes with Fluorinated Aryl Substituents","Organometallics","2012","31","7","2523","","10.1021/om200691z","","","0.71073","MoKα","","0.0532","0.0376","","","0.0603","0.0645","","","","","","1.022","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077843","14.5973","0.0013","16.0164","0.0014","18.3603","0.0016","70.015","0.004","79.973","0.004","89.535","0.004","3966.3","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H40 B10 F12 -","- C36 H40 B10 F12 -","- C144 H160 B40 F48 -","4","2","","Ward, Jas S.; Tricas, Hugo; Scott, Greig; Ellis, David; Rosair, Georgina M.; Welch, Alan J.","Facile Isomerization and Unprecedented Decarbonation of Metallacarboranes with Fluorinated Aryl Substituents","Organometallics","2012","31","7","2523","","10.1021/om200691z","","","0.71073","MoKα","","0.1091","0.0835","","","0.2115","0.2268","","","","","","1.146","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077844","12.8521","0.0005","16.2817","0.0006","33.9667","0.0012","90","","90","","90","","7107.7","0.5","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","2010src0133","","","- C32 H46 B9 Co2 F7 O -","- C32 H46 B9 Co2 F7 O -","- C256 H368 B72 Co16 F56 O8 -","8","1","","Ward, Jas S.; Tricas, Hugo; Scott, Greig; Ellis, David; Rosair, Georgina M.; Welch, Alan J.","Facile Isomerization and Unprecedented Decarbonation of Metallacarboranes with Fluorinated Aryl Substituents","Organometallics","2012","31","7","2523","","10.1021/om200691z","","","0.71073","MoKα","","0.1341","0.0899","","","0.1459","0.1601","","","","","","1.422","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077845","13.9649","0.0004","15.3595","0.0004","18.6179","0.0005","68.968","0.001","77.588","0.001","76.87","0.001","3590.63","0.17","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H55 Ge4 Ir3 O6 -","- C78 H55 Ge4 Ir3 O6 -","- C156 H110 Ge8 Ir6 O12 -","2","1","","Adams, Richard D.; Fang, Fang; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","α-Cleavage of Phenyl Groups from GePh3Ligands in Iridium Carbonyl Cluster Complexes. A Mechanism and Its Role in the Synthesis of Bridging Germylene Ligands","Organometallics","2012","31","7","2621","","10.1021/om2007002","","","0.71073","MoKα","","0.0739","0.0476","","","0.098","0.1205","","","","","","1.082","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077846","16.244","0.0005","20.8662","0.0007","24.034","0.0008","90","","91.129","0.001","90","","8144.8","0.5","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C90 H65 Ge5 Ir3 O6 -","- C90 H65 Ge5 Ir3 O6 -","- C360 H260 Ge20 Ir12 O24 -","4","1","","Adams, Richard D.; Fang, Fang; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","α-Cleavage of Phenyl Groups from GePh3Ligands in Iridium Carbonyl Cluster Complexes. A Mechanism and Its Role in the Synthesis of Bridging Germylene Ligands","Organometallics","2012","31","7","2621","","10.1021/om2007002","","","0.71073","MoKα","","0.1139","0.0785","","","0.1797","0.198","","","","","","1.086","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077847","10.3576","0.0011","14.9377","0.0016","29.463","0.003","86.979","0.002","85.865","0.002","80.614","0.002","4481.9","0.8","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H65 Ge5 Ir3 O7 -","- C96 H65 Ge5 Ir3 O7 -","- C192 H130 Ge10 Ir6 O14 -","2","1","","Adams, Richard D.; Fang, Fang; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","α-Cleavage of Phenyl Groups from GePh3Ligands in Iridium Carbonyl Cluster Complexes. A Mechanism and Its Role in the Synthesis of Bridging Germylene Ligands","Organometallics","2012","31","7","2621","","10.1021/om2007002","","","0.71073","MoKα","","0.0823","0.062","","","0.2019","0.2206","","","","","","0.963","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077848","24.9277","0.001","20.8199","0.0008","29.1842","0.0011","90","","94.232","0.001","90","","15105.1","1","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C81 H64 Ge5 Ir3 O7 -","- C81 H64 Ge5 Ir3 O7 -","- C648 H512 Ge40 Ir24 O56 -","8","1","","Adams, Richard D.; Fang, Fang; Zhang, Qiang; Hall, Michael B.; Trufan, Eszter","α-Cleavage of Phenyl Groups from GePh3Ligands in Iridium Carbonyl Cluster Complexes. A Mechanism and Its Role in the Synthesis of Bridging Germylene Ligands","Organometallics","2012","31","7","2621","","10.1021/om2007002","","","0.71073","MoKα","","0.0632","0.0422","","","0.0988","0.1109","","","","","","1.027","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077849","9.012","0.002","10.253","0.003","15.554","0.003","74.286","0.01","87.956","0.006","81.373","0.009","1367.8","0.6","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C23 H29 B9 Cl N P Rh S -","- C23 H29 B9 Cl N P Rh S -","- C46 H58 B18 Cl2 N2 P2 Rh2 S2 -","2","1","","Calvo, Beatriz; Macías, Ramón; Cunchillos, Carmen; Lahoz, Fernando J.; Oro, Luis A.","Brønsted Acid/Base Driven Chemistry with Rhodathiaboranes: A Labile {SB9H9}‒Thiadecaborane Fragment System","Organometallics","2012","31","7","2526","","10.1021/om200707m","","","0.7378","synchrotron","","0.1263","0.0961","","","0.2343","0.2696","","","","","","1.005","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077850","10.5846","0.0007","10.7947","0.0007","13.1623","0.0008","107.961","0.001","91.751","0.001","92.185","0.001","1428.15","0.16","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C24 H29 B9 Cl N O P Rh S -","- C24 H28.49 B9 Cl N O P Rh S -","- C48 H56.98 B18 Cl2 N2 O2 P2 Rh2 S2 -","2","1","","Calvo, Beatriz; Macías, Ramón; Cunchillos, Carmen; Lahoz, Fernando J.; Oro, Luis A.","Brønsted Acid/Base Driven Chemistry with Rhodathiaboranes: A Labile {SB9H9}‒Thiadecaborane Fragment System","Organometallics","2012","31","7","2526","","10.1021/om200707m","","","0.71073","MoKα","","0.0419","0.032","","","0.0733","0.078","","","","","","1.004","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077851","11.8861","0.0005","15.2456","0.0006","21.607","0.0008","90","","90","","90","","3915.4","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H24 O4 Ru Si2 -","- C15 H24 O4 Ru Si2 -","- C120 H192 O32 Ru8 Si16 -","8","1","","Casey, Charles P.; Guan, Hairong","Trimethylsilyl-Substituted Hydroxycyclopentadienyl Ruthenium Hydrides as Benchmarks to Probe Ligand and Metal Effects on the Reactivity of Shvo Type Complexes.","Organometallics","2012","31","7","2631","2638","10.1021/om2007453","","","0.71073","Mo-Kα","","0.0181","0.0167","","","0.045","0.0461","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077852","13.362","0.003","17.193","0.004","16.114","0.004","90","","98.964","0.004","90","","3656.7","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H39 N3 P2 Ru -","- C43 H39 N3 P2 Ru -","- C172 H156 N12 P8 Ru4 -","4","1","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.0923","0.0574","","","0.1299","0.1481","","","","","","1.033","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077853","21.4332","0.0016","16.4391","0.0012","17.9893","0.0014","90","","90","","90","","6338.4","0.8","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C38 H29 N3 P2 Ru -","- C38 H29 N3 P2 Ru -","- C304 H232 N24 P16 Ru8 -","8","2","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.0819","0.048","","","0.1005","0.1165","","","","","","1.015","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077854","11.4978","0.0007","17.563","0.0009","19.605","0.001","90","","100.135","0.001","90","","3897.2","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H35 N3 P2 Ru -","- C48 H35 N3 P2 Ru -","- C192 H140 N12 P8 Ru4 -","4","1","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.0349","0.0273","","","0.0697","0.075","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077855","20.905","0.001","14.7607","0.0008","23.701","0.001","90","","100.138","0.005","90","","7199.3","0.6","100","2","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C79 H78 F6 N3 Os P5 Ru -","- C79 H78 F6 N3 Os P5 Ru -","- C316 H312 F24 N12 Os4 P20 Ru4 -","4","0.5","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.1392","0.0749","","","0.191","0.2044","","","","","","1.095","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4077856","11.7459","0.0005","11.9723","0.0005","13.2917","0.0006","82.087","0.004","89.623","0.004","75.665","0.004","1792.97","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H32 Cl2 N4 P2 Ru -","- C40 H32 Cl2 N4 P2 Ru -","- C80 H64 Cl4 N8 P4 Ru2 -","2","1","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.069","0.0398","","","0.0828","0.0875","","","","","","0.927","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077857","11.1286","0.0002","17.4916","0.0003","20.1481","0.0004","90","","103.473","0.002","90","","3814.04","0.13","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H40 B F4 N3 P2 Ru -","- C43 H40 B F4 N3 P2 Ru -","- C172 H160 B4 F16 N12 P8 Ru4 -","4","1","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.1008","0.0419","","","0.0855","0.0967","","","","","","0.864","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077858","36.723","0.017","68.84","0.03","11.415","0.005","90","","90","","90","","28857","2","150","2","150","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C84 H74 F6 N3 P5 Ru2 -","- C84 H74 F6 N3 P5 Ru2 -","- C1344 H1184 F96 N48 P80 Ru32 -","16","1","","Bruce, Michael I.; Fox, Mark A.; Low, Paul J.; Nicholson, Brian K.; Parker, Christian R.; Patalinghug, Wyona C.; Skelton, Brian W.; White, Allan H.","Substitution of Tetracyanoethene by Ethynyl‒Metal Complexes Gives Tricyanovinylethynyl (Tricyanobutenynyl) Derivatives: Syntheses, Protonation, and Addition of Metal‒Ligand Fragments","Organometallics","2012","31","7","2639","","10.1021/om2007503","","","0.71073","MoKα","","0.1113","0.062","","","0.1321","0.1575","","","","","","1.014","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077859","16.328","0.003","13.462","0.003","11.636","0.002","90","","104.476","0.003","90","","2476.5","0.8","173","2","173","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C10.5 H19 Al0.5 B0.5 N3 O0.5 -","- C10.5 H19 Al0.5 B0.5 N3 O0.5 -","- C84 H152 Al4 B4 N24 O4 -","8","1","","Koller, Jürgen; Bergman, Robert G.","Controlled Hydrosilylation of Carbonyls and Imines Catalyzed by a Cationic Aluminum Alkyl Complex","Organometallics","2012","31","7","2530","","10.1021/om2008277","","","0.71073","MoKα","","0.0606","0.0488","","","0.1288","0.1381","","","","","","1.057","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077860","18.08","0.003","11.2613","0.0015","14.582","0.002","90","","111.25","0.002","90","","2767.1","0.7","133","2","133","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H27 Al B Cl2 I3 N6 -","- C17 H27 Al B Cl2 I3 N6 -","- C68 H108 Al4 B4 Cl8 I12 N24 -","4","1","","Koller, Jürgen; Bergman, Robert G.","Controlled Hydrosilylation of Carbonyls and Imines Catalyzed by a Cationic Aluminum Alkyl Complex","Organometallics","2012","31","7","2530","","10.1021/om2008277","","","0.71073","MoKα","","0.0322","0.0252","","","0.0482","0.0527","","","","","","1.131","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077861","9.5841","0.0005","14.0425","0.0006","15.6167","0.0006","90","","90.828","0.002","90","","2101.55","0.16","200","","200","","","","","","","","","3","P 1 21 1","P 2yb","4","","4-Phenyl-4,5-dihydro-3H-dinaphtho[2,1-c;1',2'-e]-arsepine","","- C28 H21 As -","- C28 H21 As -","- C112 H84 As4 -","4","2","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0993","0.0284","","0.0604","0.0298","0.0298","","","","","","1.1232","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077862","16.8728","0.0005","16.8728","0.0005","11.2567","0.0002","90","","90","","120","","2775.34","0.13","200","","200","","","","","","","","","4","P 65","P 65","170","","","","- C22 H16 As I -","- C22 H16 As I -","- C132 H96 As6 I6 -","6","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0423","0.0285","","0.0339","0.0301","0.0301","","","","","","1.0007","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077863","16.776","0.0004","16.776","0.0004","11.0926","0.0002","90","","90","","120","","2703.59","0.1","200","","200","","","","","","","","","4","P 65","P 65","170","","","","- C22 H16 As Cl -","- C22 H16 As Cl -","- C132 H96 As6 Cl6 -","6","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0492","0.0382","","0.0479","0.0423","0.0423","","","","","","1.0032","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077864","8.8101","0.0001","11.5091","0.0002","28.4709","0.0004","90","","90","","90","","2886.84","0.07","200","","200","","","","","","","","?","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H27 As Cl2 F6 P2 -","- C26 H27 As Cl2 F6 P2 -","- C104 H108 As4 Cl8 F24 P8 -","4","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0524","0.0289","","0.0412","0.0309","0.0309","","","","","","1.1069","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077865","8.277","0.0001","13.4613","0.0002","29.0898","0.0004","90","","90","","90","","3241.16","0.08","200","","200","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C34 H35 As F6 O P2 -","- C34 H35 As F6 O P2 -","- C136 H140 As4 F24 O4 P8 -","4","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0511","0.0289","","0.0522","0.037","0.0367","","","","","","0.8108","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077866","20.4881","0.0003","7.9518","0.0001","19.5861","0.0003","90","","110.29","0.0009","90","","2992.92","0.08","200","","200","","","","","","","","?","6","C 1 2 1","C 2y","5","","","","- C32 H31 As F6 O P2 -","- C32 H31 As F6 O P2 -","- C128 H124 As4 F24 O4 P8 -","4","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.0464","0.0262","","0.0401","0.03","0.03","","","","","","1.1455","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077867","18.723","0.0004","18.723","0.0004","23.0827","0.0004","90","","90","","90","","8091.7","0.3","200","","200","","","","","","","","?","6","P 43 21 2","P 4nw 2abw","96","","","","- C43 H39 As F6 O1.5 P2 -","- C41 H35 As F6 O P2 -","- C328 H280 As8 F48 O8 P16 -","8","1","","Kilah, Nathan L.; Wild, S. Bruce","Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion","Organometallics","2012","31","7","2658","","10.1021/om200853d","","","0.71073","MoKα","","0.1207","0.0389","","0.0584","0.0412","0.0412","","","","","","0.8645","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077868","13.0441","0.0014","13.3198","0.0015","14.0108","0.0015","79.51","0.001","76.093","0.001","86.026","0.002","2322.6","0.4","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H152 N4 Na2 O14 Zn2 -","- C92 H152 N4 Na2 O14 Zn2 -","- C92 H152 N4 Na2 O14 Zn2 -","1","0.5","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn‒Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.0732","0.0619","","","0.1632","0.1745","","","","","","1.028","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077869","13.277","0.003","14.628","0.003","16.393","0.003","100.071","0.004","100.134","0.004","101.4","0.004","2998.9","1.1","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H192 K2 N4 O24 Zn2 -","- C112 H192 K2 N4 O24 Zn2 -","- C112 H192 K2 N4 O24 Zn2 -","1","0.5","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn‒Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.1232","0.0696","","","0.1774","0.2209","","","","","","1.034","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077870","13.3647","0.001","29.53","0.002","13.8313","0.001","90","","92.371","0.001","90","","5454","0.7","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C104 H176 K2 N4 O18 Zn2 -","- C104 H176 K2 N4 O18 Zn2 -","- C208 H352 K4 N8 O36 Zn4 -","2","0.5","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn‒Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.0654","0.0513","","","0.1298","0.1419","","","","","","1.038","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077871","12.256","0.004","13.158","0.004","20.553","0.006","90","","91.083","0.003","90","","3313.9","1.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C72 H90 N4 Zn2 -","- C72 H90 N4 Zn2 -","- C144 H180 N8 Zn4 -","2","0.5","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn–Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.0939","0.0442","","","0.0997","0.1244","","","","","","1.006","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077872","12.684","0.003","15.004","0.003","24.541","0.005","90","","92.469","0.003","90","","4666.1","1.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H66 N2 O2 Zn -","- C52 H66 N2 O2 Zn -","- C208 H264 N8 O8 Zn4 -","4","1","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn‒Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.0687","0.0528","","","0.1405","0.1523","","","","","","1.029","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077873","24.414","0.007","14.365","0.004","23.771","0.011","90","","114.537","0.004","90","","7584","5","123","2","123","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C76 H108 K2 O21 Zn -","- C76 H108 K2 O21 Zn -","- C304 H432 K8 O84 Zn4 -","4","1","","Gao, Jing; Li, Shaoguang; Zhao, Yanxia; Wu, Biao; Yang, Xiao-Juan","Reactions of α-Diimine-Stabilized Zn‒Zn-Bonded Compounds with Phenylacetylene","Organometallics","2012","31","8","2978","","10.1021/om200868j","","","0.71073","MoKα","","0.068","0.0511","","","0.1162","0.1271","","","","","","1.047","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077874","7.9265","0.0011","9.8809","0.0013","15.145","0.002","105.555","0.002","95.967","0.002","101.465","0.002","1104.3","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H27 Fe2 N O -","- C26 H27 Fe2 N O -","- C52 H54 Fe4 N2 O2 -","2","1","","Busetto, Luigi; Mazzoni, Rita; Salmi, Mauro; Zacchini, Stefano; Zanotti, Valerio","Ferrocenes Containing a Pendant Propargylic Chain Obtained via Addition of Propargyl Alcohol to μ-Vinyliminium Ligands in Diiron Complexes","Organometallics","2012","31","7","2667","","10.1021/om200904s","","","0.71073","MoKα","","0.046","0.0362","","","0.102","0.1099","","","","","","1.04","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077875","10.1578","0.0003","25.6316","0.0002","16.3428","0.0003","90","","100.343","0.001","90","","4185.88","0.15","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H45 B9 Cl4 N P2 Rh S -","- C33 H45 B9 Cl4 N P2 Rh S -","- C132 H180 B36 Cl16 N4 P8 Rh4 S4 -","4","1","","Calvo, Beatriz; Álvarez, Álvaro; Macías, Ramón; García-Orduña, Pilar; Lahoz, Fernando J.; Oro, Luis A.","Modification of [8,8,8-(H)(PPh3)2-9-(Py)-nido-8,7-RhSB9H9], Py = NC5H5, with Monodentate Phosphines: Reactivity and Mechanistic Insights","Organometallics","2012","31","8","2986","","10.1021/om2009205","","","0.7382","synchrotron","","0.0424","0.042","","","0.1113","0.1117","","","","","","1.058","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077876","10.893","0.0011","12.0718","0.0012","14.3942","0.0014","87.299","0.002","69.594","0.001","81.418","0.001","1754.1","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C27 H39 B9 Cl2 N P2 Rh S -","- C27 H39 B9 Cl2 N P2 Rh S -","- C54 H78 B18 Cl4 N2 P4 Rh2 S2 -","2","1","","Calvo, Beatriz; Álvarez, Álvaro; Macías, Ramón; García-Orduña, Pilar; Lahoz, Fernando J.; Oro, Luis A.","Modification of [8,8,8-(H)(PPh3)2-9-(Py)-nido-8,7-RhSB9H9], Py = NC5H5, with Monodentate Phosphines: Reactivity and Mechanistic Insights","Organometallics","2012","31","8","2986","","10.1021/om2009205","","","0.71073","MoKα","","0.08","0.0481","","","0.1028","0.1154","","","","","","1.01","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077877","9.1278","0.0013","24.263","0.004","14.915","0.002","90","","103.397","0.002","90","","3213.3","0.8","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H37 B9 Cl2 N P2 Rh S -","- C22 H37 B9 Cl2 N P2 Rh S -","- C88 H148 B36 Cl8 N4 P8 Rh4 S4 -","4","1","","Calvo, Beatriz; Álvarez, Álvaro; Macías, Ramón; García-Orduña, Pilar; Lahoz, Fernando J.; Oro, Luis A.","Modification of [8,8,8-(H)(PPh3)2-9-(Py)-nido-8,7-RhSB9H9], Py = NC5H5, with Monodentate Phosphines: Reactivity and Mechanistic Insights","Organometallics","2012","31","8","2986","","10.1021/om2009205","","","0.71073","MoKα","","0.0637","0.0591","","","0.1462","0.1487","","","","","","1.17","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077878","20.654","0.004","13.466","0.003","19.897","0.004","90","","101.06","0.006","90","","5431.1","1.9","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H30 B Br N2 O6 Pt -","- C25 H30 B Br N2 O6 Pt -","- C200 H240 B8 Br8 N16 O48 Pt8 -","8","2","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.0867","0.0432","","","0.0677","0.0809","","","","","","1.005","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077879","7.2944","0.0004","12.9087","0.0007","28.1177","0.0015","90","","91.641","0.002","90","","2646.5","0.2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H30 B Br N2 O6 Pt -","- C25 H30 B Br N2 O6 Pt -","- C100 H120 B4 Br4 N8 O24 Pt4 -","4","1","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.0536","0.0305","","","0.0493","0.0549","","","","","","1.023","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077880","11.451","0.004","12.132","0.004","12.267","0.004","92.106","0.009","112.053","0.009","117.416","0.008","1355.8","0.8","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H30 B Br N2 O6 Pt -","- C25 H30 B Br N2 O6 Pt -","- C50 H60 B2 Br2 N4 O12 Pt2 -","2","1","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.0683","0.0402","","","0.0651","0.073","","","","","","1.022","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077881","18.8686","0.0017","9.0871","0.0006","14.2187","0.001","90","","97.755","0.006","90","","2415.7","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 B Br N5 O3 Pt -","- C23 H22 B Br N5 O3 Pt -","- C92 H88 B4 Br4 N20 O12 Pt4 -","4","1","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.1161","0.0567","","","0.104","0.1263","","","","","","0.988","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077882","13.9473","0.0019","12.0619","0.0015","13.4461","0.0018","90","","90.468","0.004","90","","2262","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 B Br N4 O3 Pt -","- C21 H22 B Br N4 O3 Pt -","- C84 H88 B4 Br4 N16 O12 Pt4 -","4","1","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.1156","0.0556","","","0.1041","0.1254","","","","","","0.997","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077883","7.5558","0.0004","22.7203","0.001","14.3006","0.0007","90","","108.863","0.004","90","","2323.1","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 B Br N4 O3 Pt -","- C21 H22 B Br N4 O3 Pt -","- C84 H88 B4 Br4 N16 O12 Pt4 -","4","1","","Safa, Muhieddine A.; Abo-Amer, Anwar; Borecki, Aneta; Cooper, Benjamin F. T.; Puddephatt, Richard J.","Synthesis and Self-Association of Organoplatinum(IV) Boronic Acids","Organometallics","2012","31","7","2675","","10.1021/om2009217","","","0.71073","MoKα","","0.1141","0.0483","","","0.0833","0.1043","","","","","","0.996","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077884","17.6641","0.0005","13.634","0.0004","19.1235","0.0005","90","","112.724","0.001","90","","4248.1","0.2","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","[Y{C5H3(SiMe3)2}3]","","","- C33 H63 Si6 Y -","- C33 H63 Si6 Y -","- C132 H252 Si24 Y4 -","4","1","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.0986","0.0544","","","0.089","0.1029","","","","","","1.033","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077885","17.6367","0.0002","13.617","0.0002","19.1352","0.0003","90","","112.832","0.001","90","","4235.42","0.11","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","[Yb{C5H3(SiMe3)2}3]","","","- C33 H63 Si6 Yb -","- C33 H63 Si6 Yb -","- C132 H252 Si24 Yb4 -","4","1","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.048","0.0297","","","0.05","0.0545","","","","","","1.013","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077886","11.1588","0.0007","21.3288","0.0015","12.5461","0.0009","90","","92.927","0.003","90","","2982.1","0.4","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","[Pb{C5H3(SiMe3)2}2]","","","- C22 H42 Pb Si4 -","- C22 H42 Pb Si4 -","- C88 H168 Pb4 Si16 -","4","1","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞ ]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.1001","0.0656","","","0.1188","0.1291","","","","","","1.144","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077887","12.0772","0.0003","15.792","0.0006","15.5361","0.0006","90","","100.045","0.002","90","","2917.67","0.17","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","[{Y(OH)(C5H3(SiMe3)2)2}2]","","","- C44 H86 O2 Si8 Y2 -","- C44 H86 O2 Si8 Y2 -","- C88 H172 O4 Si16 Y4 -","2","0.5","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.0742","0.0446","","","0.0806","0.0897","","","","","","1.046","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077888","11.9444","0.0003","16.1291","0.0006","15.2303","0.0006","90","","98.549","0.002","90","","2901.55","0.17","173","2","173","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","[{Cp""2Sc}2(C2H4)]","","","- C46 H88 Sc2 Si8 -","- C46 H88 Sc2 Si8 -","- C92 H176 Sc4 Si16 -","2","0.5","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.0576","0.0403","","","0.0816","0.0882","","","","","","1.024","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077889","11.4065","0.0002","11.8768","0.0002","19.0856","0.0003","72.988","0.001","85.189","0.001","70.963","0.001","2337.03","0.07","173","2","173","2","","","","","","","synthesis as described","7","P -1","-P 1","2","[(18-crown-6)KClYbCl{C5H3(SiMe3)2}2]","","","- C34 H66 Cl2 K O6 Si4 Yb -","- C34 H66 Cl2 K O6 Si4 Yb -","- C68 H132 Cl4 K2 O12 Si8 Yb2 -","2","1","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞ ]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.0251","0.0224","","","0.0506","0.0519","","","","","","1.056","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077890","19.025","0.005","11.671","0.009","21.525","0.005","90","","93.32","0.02","90","","4771","4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H66 Cl2 K La O6 Si4 -","- C34 H66 Cl2 K La O6 Si4 -","- C136 H264 Cl8 K4 La4 O24 Si16 -","4","1","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","","0.71073","MoKα","","0.0998","0.0534","","","0.0992","0.1159","","","","","","0.999","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077891","11.4794","0.0005","12.5636","0.0005","21.2707","0.0009","90","","90","","90","","3067.7","0.2","173","2","173","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","[K{C5H3(SiMe3)2}]","","","- C11 H21 K Si2 -","- C11 H21 K Si2 -","- C88 H168 K8 Si16 -","8","2","","Coles, Martyn P.; Hitchcock, Peter B.; Lappert, Michael F.; Protchenko, Andrey V.","Syntheses and Structures of the Crystalline, Highly Crowded 1,3-Bis(trimethylsilyl)cyclopentadienyls [MCp″3] (M = Y, Er, Yb), [PbCp″2], [{YCp″2(μ-OH)}2], [(ScCp″2)2(μ-η2:η2-C2H4)], [YbCp″2Cl(μ-Cl)K(18-crown-6)], and [{KCp″}∞]","Organometallics","2012","31","7","2682","","10.1021/om2009364","","x-ray","0.71073","MoKα","","0.0424","0.0375","","","0.1105","0.1168","","","","","","0.773","","","","has coordinates,has disorder","187017","2020-10-21","18:00:00",""
"4077892","9.5125","0.0002","10.2874","0.0003","16.9338","0.0005","87.803","0.001","85.979","0.001","76.221","0.001","1605.07","0.08","150","2","150","2","","","","","","","synthesized by the authors","5","P -1","-P 1","2","","","","- C24 H45 B10 P3 Pt -","- C24 H45 B10 P3 Pt -","- C48 H90 B20 P6 Pt2 -","2","1","","Bould, Jonathan; Císařová, Ivana; Kennedy, John D.","Polyhedral Platinaborane Chemistry. Interaction of PMe2Ph with [(PMe2Ph)2PtB10H12]","Organometallics","2012","31","7","2691","","10.1021/om200940h","","","0.71073","MoKα","","0.0117","0.0103","","","0.0237","0.0242","","","","","","1.107","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077893","13.632","0.002","13.727","0.001","14.1396","0.0008","69","0.02","63.64","0.02","61.9","0.02","2053.7","0.6","123.2","","123.2","","","","","","","","","7","P -1","-P 1","2","","","","- C38 H31 F6 N9 O6 Rh2 S2 -","- C38 H31 F6 N9 O6 Rh2 S2 -","- C76 H62 F12 N18 O12 Rh4 S4 -","2","1","","Inoki, Daisuke; Matsumoto, Takahiro; Nakai, Hidetaka; Ogo, Seiji","Experimental Study of Reductive Elimination of H2from Rhodium Hydride Species","Organometallics","2012","31","8","2996","","10.1021/om2009759","","","0.7107","MoKα","","","0.0436","","","","0.09","","","","","","1.002","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077894","11.757","0.002","40.153","0.008","11.907","0.003","90","","108.969","0.003","90","","5315.8","1.9","123.2","","123.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H34 F12 N10 O12 Rh2 S4 -","- C42 H34 F12 N10 O12 Rh2 S4 -","- C168 H136 F48 N40 O48 Rh8 S16 -","4","1","","Inoki, Daisuke; Matsumoto, Takahiro; Nakai, Hidetaka; Ogo, Seiji","Experimental Study of Reductive Elimination of H2from Rhodium Hydride Species","Organometallics","2012","31","8","2996","","10.1021/om2009759","","","0.7107","MoKα","","","0.0319","","","","0.0823","","","","","","0.997","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077895","17.2928","0.0006","10.4178","0.0004","13.6469","0.0005","90","","103.161","0.002","90","","2393.95","0.15","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H28 Cl2 N2 O2 Pd S2 -","- C19 H28 Cl2 N2 O2 Pd S2 -","- C76 H112 Cl8 N8 O8 Pd4 S8 -","4","1","","Mart\?ínez-Martínez, Antonio-Jesús; Vicente, José; Chicote, Mar\?ía-Teresa; Bautista, Delia","Synthesis and Reactivity of [PdCl2{C,N-C6H4C(═NHXy)NH2-2}] and Neutral Palladium 1,2-Dihydroquinazolinium-4-yl Complexes: Depalladation Reactions","Organometallics","2012","31","7","2697","","10.1021/om200986k","","","0.71073","MoKα","","0.0212","0.0202","","","0.0506","0.0511","","","","","","1.09","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077896","11.3406","0.0009","11.5447","0.0009","14.9407","0.0011","89.173","0.002","83.977","0.002","68.88","0.002","1814","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C36.5 H39.5 Cl3 N2 O4.75 P Pd -","- C36.5 H39.5 Cl3 N2 O4.75 P Pd -","- C73 H79 Cl6 N4 O9.5 P2 Pd2 -","2","1","","Mart\?ínez-Martínez, Antonio-Jesús; Vicente, José; Chicote, Mar\?ía-Teresa; Bautista, Delia","Synthesis and Reactivity of [PdCl2{C,N-C6H4C(═NHXy)NH2-2}] and Neutral Palladium 1,2-Dihydroquinazolinium-4-yl Complexes: Depalladation Reactions","Organometallics","2012","31","7","2697","","10.1021/om200986k","","","0.71073","MoKα","","0.0437","0.0428","","","0.0997","0.1002","","","","","","1.157","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077897","16.0745","0.0007","11.5809","0.0005","17.5504","0.0008","90","","115.367","0.002","90","","2952.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H30 Cl5 N3 Pd -","- C28 H30 Cl5 N3 Pd -","- C112 H120 Cl20 N12 Pd4 -","4","1","","Mart\?ínez-Martínez, Antonio-Jesús; Vicente, José; Chicote, Mar\?ía-Teresa; Bautista, Delia","Synthesis and Reactivity of [PdCl2{C,N-C6H4C(═NHXy)NH2-2}] and Neutral Palladium 1,2-Dihydroquinazolinium-4-yl Complexes: Depalladation Reactions","Organometallics","2012","31","7","2697","","10.1021/om200986k","","","0.71073","MoKα","","0.0354","0.0312","","","0.0673","0.0691","","","","","","1.093","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077898","17.0508","0.0009","8.7019","0.0005","26.1081","0.0014","90","","101.108","0.002","90","","3801.2","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H19 F3 N2 O3 S -","- C19 H19 F3 N2 O3 S -","- C152 H152 F24 N16 O24 S8 -","8","1","","Mart\?ínez-Martínez, Antonio-Jesús; Vicente, José; Chicote, Mar\?ía-Teresa; Bautista, Delia","Synthesis and Reactivity of [PdCl2{C,N-C6H4C(═NHXy)NH2-2}] and Neutral Palladium 1,2-Dihydroquinazolinium-4-yl Complexes: Depalladation Reactions","Organometallics","2012","31","7","2697","","10.1021/om200986k","","","0.71073","MoKα","","0.0481","0.0449","","","0.1121","0.1145","","","","","","1.037","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4077899","9.863","0.0005","13.6016","0.0007","18.8836","0.001","90","","93.97","0.003","90","","2527.2","0.2","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 O10 P2 W2 -","- C22 H12 O10 P2 W2 -","- C88 H48 O40 P8 W8 -","4","1","","Duffy, Matthew P.; Ting, Liow Yu; Nicholls, Leo; Li, Yongxin; Ganguly, Rakesh; Mathey, François","Reaction of Terminal Phosphinidene Complexes with Dihydrogen","Organometallics","2012","31","7","2936","","10.1021/om2009974","","","0.71073","MoKα","","0.0296","0.0235","","","0.0506","0.0583","","","","","","1.07","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077900","6.6181","0.0002","8.0445","0.0002","9.5458","0.0002","83.889","0.001","75.274","0.001","75.041","0.001","474.41","0.02","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 O10 P2 W2 -","- C12 H8 O10 P2 W2 -","- C12 H8 O10 P2 W2 -","1","0.5","","Duffy, Matthew P.; Ting, Liow Yu; Nicholls, Leo; Li, Yongxin; Ganguly, Rakesh; Mathey, François","Reaction of Terminal Phosphinidene Complexes with Dihydrogen","Organometallics","2012","31","7","2936","","10.1021/om2009974","","","0.71073","MoKα","","0.0134","0.0127","","","0.0284","0.0311","","","","","","1.145","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077901","9.7581","0.0002","18.3584","0.0003","10.6825","0.0002","90","","105.725","0.001","90","","1842.07","0.06","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 N2 O5 P W -","- C17 H13 N2 O5 P W -","- C68 H52 N8 O20 P4 W4 -","4","1","","Duffy, Matthew P.; Ting, Liow Yu; Nicholls, Leo; Li, Yongxin; Ganguly, Rakesh; Mathey, François","Reaction of Terminal Phosphinidene Complexes with Dihydrogen","Organometallics","2012","31","7","2936","","10.1021/om2009974","","","0.71073","MoKα","","0.0318","0.022","","","0.0535","0.0717","","","","","","1.174","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077902","13.4238","0.0001","14.2954","0.0001","20.7081","0.0002","73.4829","0.0004","84.0057","0.0004","83.9868","0.0004","3777.28","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C83 H65 B F24 O P3 Rh -","- C83 H65 B F24 O P3 Rh -","- C166 H130 B2 F48 O2 P6 Rh2 -","2","1","","Dallanegra, Romaeo; Chaplin, Adrian B.; Weller, Andrew S.","Rhodium Cyclopentyl Phosphine Complexes of Wide-Bite-Angle Ligands DPEphos and Xantphos","Organometallics","2012","31","7","2720","","10.1021/om201034m","","","0.71073","MoKα","","0.0427","0.0329","","","0.0748","0.0794","","","","","","1.03","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077903","12.8119","0.0001","16.2707","0.0002","20.9044","0.0002","84.2396","0.0004","72.9026","0.0004","85.5884","0.0004","4138.93","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H69 B F24 O P3 Rh -","- C86 H69 B F24 O P3 Rh -","- C172 H138 B2 F48 O2 P6 Rh2 -","2","1","","Dallanegra, Romaeo; Chaplin, Adrian B.; Weller, Andrew S.","Rhodium Cyclopentyl Phosphine Complexes of Wide-Bite-Angle Ligands DPEphos and Xantphos","Organometallics","2012","31","7","2720","","10.1021/om201034m","","","0.71073","MoKα","","0.0513","0.042","","","0.1138","0.119","","","","","","1.073","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077904","13.3042","0.0003","17.7665","0.0003","20.6626","0.0005","111.757","0.0009","97.3499","0.0008","94.8652","0.0011","4452.23","0.17","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C89 H74 B F25 O P3 Rh -","- C89 H74 B F25 O P3 Rh -","- C178 H148 B2 F50 O2 P6 Rh2 -","2","1","","Dallanegra, Romaeo; Chaplin, Adrian B.; Weller, Andrew S.","Rhodium Cyclopentyl Phosphine Complexes of Wide-Bite-Angle Ligands DPEphos and Xantphos","Organometallics","2012","31","7","2720","","10.1021/om201034m","","","0.71073","MoKα","","0.075","0.051","","","0.1327","0.1435","","","","","","1.055","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077905","13.9956","0.0001","33.5274","0.0003","17.8616","0.0002","90","","108.154","0.0004","90","","7964.09","0.13","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C83 H67 B F24 O P3 Rh -","- C83 H67 B F24 O P3 Rh -","- C332 H268 B4 F96 O4 P12 Rh4 -","4","1","","Dallanegra, Romaeo; Chaplin, Adrian B.; Weller, Andrew S.","Rhodium Cyclopentyl Phosphine Complexes of Wide-Bite-Angle Ligands DPEphos and Xantphos","Organometallics","2012","31","7","2720","","10.1021/om201034m","","","0.71073","MoKα","","0.0907","0.0572","","","0.1244","0.1396","","","","","","1.042","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077906","12.859","0.0001","17.1395","0.0001","21.8146","0.0002","99.1448","0.0004","106.805","0.0004","100.704","0.0004","4405.41","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H71 B F24 O P3 Rh -","- C86 H71 B F24 O P3 Rh -","- C172 H142 B2 F48 O2 P6 Rh2 -","2","1","","Dallanegra, Romaeo; Chaplin, Adrian B.; Weller, Andrew S.","Rhodium Cyclopentyl Phosphine Complexes of Wide-Bite-Angle Ligands DPEphos and Xantphos","Organometallics","2012","31","7","2720","","10.1021/om201034m","","","0.71073","MoKα","","0.103","0.0991","","","0.2533","0.2549","","","","","","1.115","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077907","8.7669","0.0004","10.4373","0.0005","20.9854","0.0011","90","","91.383","0.004","90","","1919.66","0.16","140","1","140","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14.5 H24 Cl F6 S Sb -","- C14.5 H23 Cl F6 S Sb -","- C58 H92 Cl4 F24 S4 Sb4 -","4","1","","Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred","Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination","Organometallics","2012","31","7","2534","","10.1021/om201035v","","","0.71073","Mo-Kα","","0.0396","0.0347","","","0.082","0.0833","","","","","","1.153","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077908","12.0274","0.0002","7.9197","0.0007","17.4074","0.0009","90","","108.949","0.005","90","","1568.26","0.17","140","1","140","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 F6 S Sb -","- C12 H19 F6 S Sb -","- C48 H76 F24 S4 Sb4 -","4","1","","Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred","Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination","Organometallics","2012","31","7","2534","","10.1021/om201035v","","","0.71073","Mo-Kα","","0.0424","0.0338","","","0.0796","0.0825","","","","","","1.066","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077909","8.62","0.0003","11.0278","0.0003","11.6892","0.0004","66.587","0.003","88.441","0.002","86.652","0.002","1017.93","0.06","140","1","140","1","","","","","","","","6","P -1","-P 1","2","","","","- C16.5 H26 Cl F6 S Sb -","- C16.5 H26 Cl F6 S Sb -","- C33 H52 Cl2 F12 S2 Sb2 -","2","1","","Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred","Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination","Organometallics","2012","31","7","2534","","10.1021/om201035v","","","0.71073","Mo-Kα","","0.0253","0.0214","","","0.056","0.0566","","","","","","1.054","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077910","25.5825","0.0004","8.66762","0.00011","16.1148","0.0003","90","","94.2792","0.014","90","","3563.32","0.12","140","1","140","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12.5 H20 Cl F6 S Sb -","- C12.5 H19 Cl F6 S Sb -","- C100 H152 Cl8 F48 S8 Sb8 -","8","1","","Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred","Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination","Organometallics","2012","31","7","2534","","10.1021/om201035v","","","0.71073","Mo-Kα","","0.0298","0.0223","","","0.0557","0.0569","","","","","","1.017","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077911","44.765","0.003","7.8085","0.0003","21.6181","0.0013","90","","93.833","0.005","90","","7539.6","0.7","140","1","140","1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C8 H24 Au2 F12 S4 Sb2 -","- C8 H24 Au2 F12 S4 Sb2 -","- C96 H288 Au24 F144 S48 Sb24 -","12","1.5","","Savjani, Nicky; Bew, Sean P.; Hughes, David L.; Lancaster, Simon J.; Bochmann, Manfred","Reactivity of “Ligand-Free” Au+: C‒H and C‒C Activation versus π Coordination","Organometallics","2012","31","7","2534","","10.1021/om201035v","","","0.71073","Mo-Kα","","0.1544","0.086","","","0.1318","0.1521","","","","","","1.013","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077912","8.867","0.0001","13.3363","0.0003","34.4243","0.0005","90","","90","","90","","4070.78","0.12","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C47.5 H40 N6 O1.5 Pt2 -","- C47.5 H40 N6 O1.5 Pt2 -","- C190 H160 N24 O6 Pt8 -","4","1","","Forniés, Juan; Fuertes, Sara; Larraz, Carmen; Martín, Antonio; Sicilia, Violeta; Tsipis, Athanassios C.","Synthesis and Characterization of the Double Salts [Pt(bzq)(CNR)2][Pt(bzq)(CN)2] with Significant Pt···Pt and π···π Interactions. Mechanistic Insights into the Ligand Exchange Process from Joint Experimental and DFT Study","Organometallics","2012","31","7","2729","","10.1021/om201036z","","","0.71073","MoKα","","0.0419","0.0333","","","0.0633","0.0647","","","","","","1.011","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077913","12.3079","0.0003","11.1195","0.0002","16.0997","0.0004","90","","105.153","0.002","90","","2126.76","0.09","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H25 Cl3 N4 Ti -","- C20 H25 Cl3 N4 Ti -","- C80 H100 Cl12 N16 Ti4 -","4","1","","Helgert, Theodore R.; Hollis, T. Keith; Valente, Edward J.","Synthesis of Titanium CCC-NHC Pincer Complexes and Catalytic Hydroamination of Unactivated Alkenes","Organometallics","2012","31","8","3002","","10.1021/om2010436","","","0.71073","MoKα","","0.0302","0.0237","","","0.0581","0.0593","","","","","","1.003","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077914","11.8116","0.0003","13.0347","0.0003","15.5092","0.0003","90","","93.963","0.002","90","","2382.1","0.09","101","2","101","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H31 Cl2 N5 Ti -","- C22 H31 Cl2 N5 Ti -","- C88 H124 Cl8 N20 Ti4 -","4","1","","Helgert, Theodore R.; Hollis, T. Keith; Valente, Edward J.","Synthesis of Titanium CCC-NHC Pincer Complexes and Catalytic Hydroamination of Unactivated Alkenes","Organometallics","2012","31","8","3002","","10.1021/om2010436","","","0.71073","MoKα","","0.0548","0.0311","","","0.0635","0.0658","","","","","","0.955","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077915","19.3158","0.0004","8.817","0.0002","25.1475","0.0005","90","","90","","90","","4282.81","0.16","143","1","143","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H27 B7 Fe Si -","- C19 H27 B7 Fe Si -","- C152 H216 B56 Fe8 Si8 -","8","1","","Perez-Gavilan, Ariane; Carroll, Patrick J.; Sneddon, Larry G.","Efficient and Systematic Click-Based Synthetic Routes to Amino Acid Functionalized Metallatricarbadecaboranes","Organometallics","2012","31","7","2741","","10.1021/om201044r","","","0.71073","MoKα","","0.039","0.0286","","","0.0663","0.0714","","","","","","0.993","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077916","9.5587","0.0014","13.199","0.002","13.245","0.002","90","","94.486","0.003","90","","1665.9","0.4","143","1","143","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 B7 Fe -","- C16 H19 B7 Fe -","- C64 H76 B28 Fe4 -","4","1","","Perez-Gavilan, Ariane; Carroll, Patrick J.; Sneddon, Larry G.","Efficient and Systematic Click-Based Synthetic Routes to Amino Acid Functionalized Metallatricarbadecaboranes","Organometallics","2012","31","7","2741","","10.1021/om201044r","","","0.71073","MoKα","","0.0471","0.041","","","0.0977","0.1032","","","","","","1.084","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077917","9.6436","0.0008","13.2356","0.001","13.466","0.001","90","","95.869","0.002","90","","1709.8","0.2","170","1","170","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 B7 Ru -","- C16 H19 B7 Ru -","- C64 H76 B28 Ru4 -","4","1","","Perez-Gavilan, Ariane; Carroll, Patrick J.; Sneddon, Larry G.","Efficient and Systematic Click-Based Synthetic Routes to Amino Acid Functionalized Metallatricarbadecaboranes","Organometallics","2012","31","7","2741","","10.1021/om201044r","","","0.71073","MoKα","","0.0535","0.0419","","","0.1101","0.1213","","","","","","1.071","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077918","16.615","0.004","9.876","0.002","31.354","0.008","90","","91.289","0.003","90","","5144","2","140","1","140","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H26 B7 N3 Ru -","- C23 H26 B7 N3 Ru -","- C184 H208 B56 N24 Ru8 -","8","1","","Perez-Gavilan, Ariane; Carroll, Patrick J.; Sneddon, Larry G.","Efficient and Systematic Click-Based Synthetic Routes to Amino Acid Functionalized Metallatricarbadecaboranes","Organometallics","2012","31","7","2741","","10.1021/om201044r","","","0.71073","MoKα","","0.0577","0.0504","","","0.1453","0.1525","","","","","","1.081","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077919","9.5448","0.0004","16.426","0.0009","25.1954","0.0013","90","","88.649","0.004","90","","3949.1","0.3","100","2","100","0.1","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H54 Cl Mo2 O6 P -","- C39 H54 Cl Mo2 O6 P -","- C156 H216 Cl4 Mo8 O24 P4 -","4","1","","Alvarez, M. Angeles; Amor, Inmaculada; García, M. Esther; García-Vivó, Daniel; Ruiz, Miguel A.; Suárez, Jaime","Reactivity of the Phosphinidene-Bridged Complexes [Mo2Cp(μ-κ1:κ1,η5-PC5H4)(η6-1,3,5-C6H3tBu3)(CO)2] and [Mo2Cp2(μ-PH)(η6-1,3,5-C6H3tBu3)(CO)2] toward Alkynes: Multicomponent Reactions in the Presence of Ligands","Organometallics","2012","31","7","2749","","10.1021/om201048s","","x-ray","0.71073","MoKα","","0.1488","0.0648","","","0.1227","0.1548","","","","","","0.988","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077920","21.585","0.003","21.581","0.003","21.924","0.003","90","","93.659","0.002","90","","10192","2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H41 Cl2 O7 P3 Ru3 S2 -","- C51 H40 Cl2 O7 P3 Ru3 S2 -","- C408 H320 Cl16 O56 P24 Ru24 S16 -","8","2","","Hossain, Md. Iqbal; Sikder, Md. Delwar H.; Ghosh, Shishir; Kabir, Shariff E.; Hogarth, Graeme; Salassa, Luca","Reactivity of Triruthenium Furyne and Thiophyne Clusters: Multiple Additions of Thiolato and Selenolato Ligands through Oxidative Addition of S‒H and Se‒H Bonds","Organometallics","2012","31","7","2546","","10.1021/om201052u","","","0.71073","MoKα","","0.1661","0.078","","","0.1596","0.1912","","","","","","0.956","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077921","20.046","0.003","12.57","0.002","21.113","0.004","90","","112.08","0.002","90","","4929.8","1.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H41 Cl2 O5 P3 Ru3 S4 -","- C51 H41 Cl2 O5 P3 Ru3 S4 -","- C204 H164 Cl8 O20 P12 Ru12 S16 -","4","1","","Hossain, Md. Iqbal; Sikder, Md. Delwar H.; Ghosh, Shishir; Kabir, Shariff E.; Hogarth, Graeme; Salassa, Luca","Reactivity of Triruthenium Furyne and Thiophyne Clusters: Multiple Additions of Thiolato and Selenolato Ligands through Oxidative Addition of S‒H and Se‒H Bonds","Organometallics","2012","31","7","2546","","10.1021/om201052u","","","0.71073","MoKα","","0.0961","0.0727","","","0.2024","0.2209","","","","","","1.114","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077922","16.5099","0.0011","15.184","0.001","18.735","0.0012","90","","102.05","0.001","90","","4593.1","0.5","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H42 Cl2 O5 P3 Ru3 S4 -","- C43 H41 Cl2 O5 P3 Ru3 S4 -","- C172 H164 Cl8 O20 P12 Ru12 S16 -","4","1","","Hossain, Md. Iqbal; Sikder, Md. Delwar H.; Ghosh, Shishir; Kabir, Shariff E.; Hogarth, Graeme; Salassa, Luca","Reactivity of Triruthenium Furyne and Thiophyne Clusters: Multiple Additions of Thiolato and Selenolato Ligands through Oxidative Addition of S‒H and Se‒H Bonds","Organometallics","2012","31","7","2546","","10.1021/om201052u","","","0.71073","MoKα","","0.1398","0.0632","","","0.0889","0.1113","","","","","","0.936","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077923","16.842","0.002","15.2144","0.0019","18.792","0.002","90","","101.997","0.002","90","","4710.1","1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H43 Cl2 O3 P3 Ru3 S6 -","- C43 H39 Cl2 O3 P3 Ru3 S6 -","- C172 H156 Cl8 O12 P12 Ru12 S24 -","4","1","","Hossain, Md. Iqbal; Sikder, Md. Delwar H.; Ghosh, Shishir; Kabir, Shariff E.; Hogarth, Graeme; Salassa, Luca","Reactivity of Triruthenium Furyne and Thiophyne Clusters: Multiple Additions of Thiolato and Selenolato Ligands through Oxidative Addition of S‒H and Se‒H Bonds","Organometallics","2012","31","7","2546","","10.1021/om201052u","","","0.71073","MoKα","","0.0344","0.0275","","","0.0711","0.0724","","","","","","1.107","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077924","14.635","0.003","18.585","0.003","50.286","0.009","90","","90","","90","","13677","4","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C75 H65 O6 P3 Ru3 Se4 -","- C75 H64 O6 P3 Ru3 Se4 -","- C600 H512 O48 P24 Ru24 Se32 -","8","2","","Hossain, Md. Iqbal; Sikder, Md. Delwar H.; Ghosh, Shishir; Kabir, Shariff E.; Hogarth, Graeme; Salassa, Luca","Reactivity of Triruthenium Furyne and Thiophyne Clusters: Multiple Additions of Thiolato and Selenolato Ligands through Oxidative Addition of S‒H and Se‒H Bonds","Organometallics","2012","31","7","2546","","10.1021/om201052u","","","0.71073","MoKα","","0.0741","0.0503","","","0.1023","0.1116","","","","","","1.06","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077925","14.1283","0.0002","17.1504","0.0002","23.2541","0.0003","81.7881","0.0006","88.8624","0.0007","78.6851","0.0005","5468.25","0.12","200","","200","","","","","","","","local","8","P -1","-P 1","2","","","","- C90 H88 B2 Cl12 Ir4 Mo6 N12 O18 -","- C90 H88 B2 Cl12 Ir4 Mo6 N12 O18 -","- C180 H176 B4 Cl24 Ir8 Mo12 N24 O36 -","2","1","","Randles, Michael D.; Dewhurst, Rian D.; Cifuentes, Marie P.; Humphrey, Mark G.","Mixed-Metal Cluster Chemistry. 31.(1) Reactions of Dimolybdenum‒Diiridium Clusters with Alkylidyne Complexes","Organometallics","2012","31","7","2582","","10.1021/om201053s","","","0.71073","MoKα","","0.0638","0.0439","","0.1138","0.1029","0.1138","","","","","","0.9896","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077926","17.4282","0.0004","14.7952","0.0003","17.9635","0.0003","90","","110.019","0.0012","90","","4352.08","0.16","200","","200","","","","","","","","local","10","P 1 21/n 1","-P 2yn","14","","","","- C36 H30 B Cl2 Ir2 Mo2 N6 O10 Si W -","- C36 H30 B Cl2 Ir2 Mo2 N6 O10 Si W -","- C144 H120 B4 Cl8 Ir8 Mo8 N24 O40 Si4 W4 -","4","1","","Randles, Michael D.; Dewhurst, Rian D.; Cifuentes, Marie P.; Humphrey, Mark G.","Mixed-Metal Cluster Chemistry. 31.(1) Reactions of Dimolybdenum‒Diiridium Clusters with Alkylidyne Complexes","Organometallics","2012","31","7","2582","","10.1021/om201053s","","","0.71073","MoKα","","0.0628","0.0459","","0.1846","0.123","0.1846","","","","","","0.8051","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077927","11.624","0.0003","12.8133","0.0005","13.7322","0.0005","78.734","0.0016","85.573","0.002","89.436","0.002","1999.87","0.12","200","","200","","","","","","","","local","8","P -1","-P 1","2","","","","- C35 H28 B Cl2 Ir2 Mo3 N6 O8 -","- C35 H28 B Cl2 Ir2 Mo3 N6 O8 -","- C70 H56 B2 Cl4 Ir4 Mo6 N12 O16 -","2","1","","Randles, Michael D.; Dewhurst, Rian D.; Cifuentes, Marie P.; Humphrey, Mark G.","Mixed-Metal Cluster Chemistry. 31.(1) Reactions of Dimolybdenum‒Diiridium Clusters with Alkylidyne Complexes","Organometallics","2012","31","7","2582","","10.1021/om201053s","","","0.71073","MoKα","","0.0685","0.0375","","0.1423","0.1046","0.1423","","","","","","0.8722","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077928","33.8516","0.0004","13.944","0.0002","16.3341","0.0002","90","","104.012","0.0007","90","","7480.72","0.17","200","","200","","","","","","","","local","9","C 1 2/c 1","-C 2yc","15","","","","- C30 H52 B Cl N6 Ni O2 P2 W -","- C30 H52 B Cl N6 Ni O2 P2 W -","- C240 H416 B8 Cl8 N48 Ni8 O16 P16 W8 -","8","1","","Hill, Anthony F.; Sharma, Manab; Willis, Anthony C.","Heterodinuclear Bridging Carbido and Phosphoniocarbyne Complexes","Organometallics","2012","31","7","2538","","10.1021/om201057c","","","0.71073","MoKα","","0.041","0.0293","","0.0684","0.0636","0.0684","","","","","","0.9767","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077929","10.6496","0.0001","17.6512","0.0002","20.4901","0.0002","90","","90","","90","","3851.69","0.07","200","","200","","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C30 H52 B Cl N6 Ni O2 P2 W -","- C30 H52 B Cl N6 Ni O2 P2 W -","- C120 H208 B4 Cl4 N24 Ni4 O8 P8 W4 -","4","1","","Hill, Anthony F.; Sharma, Manab; Willis, Anthony C.","Heterodinuclear Bridging Carbido and Phosphoniocarbyne Complexes","Organometallics","2012","31","7","2538","","10.1021/om201057c","","","0.71073","MoKα","","0.0364","0.0289","","0.0594","0.0566","0.0594","","","","","","0.9895","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077930","15.8935","0.0006","15.9458","0.0006","13.0754","0.0005","90","","102.558","0.002","90","","3234.5","0.2","123","","123","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H26 F12 Fe N10 P2 -","- C25 H26 F12 Fe N10 P2 -","- C100 H104 F48 Fe4 N40 P8 -","4","0.5","","Raba, Andreas; Cokoja, Mirza; Ewald, Stefan; Riener, Korbinian; Herdtweck, Eberhardt; Pöthig, Alexander; Herrmann, Wolfgang A.; Kühn, Fritz E.","Synthesis and Characterization of Novel Iron(II) Complexes with Tetradentate Bis(N-heterocyclic carbene)‒Bis(pyridine) (NCCN) Ligands","Organometallics","2012","31","7","2793","","10.1021/om2010673","","x-ray","0.71073","MoKα","","0.0361","0.0343","","","0.0883","0.0897","","","","","","1.054","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077931","15.7026","0.0006","16.2632","0.0006","13.9422","0.0005","90","","107.94","0.0017","90","","3387.4","0.2","123","1","123","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 F12 Fe N10 P2 -","- C26 H28 F12 Fe N10 P2 -","- C104 H112 F48 Fe4 N40 P8 -","4","0.5","","Raba, Andreas; Cokoja, Mirza; Ewald, Stefan; Riener, Korbinian; Herdtweck, Eberhardt; Pöthig, Alexander; Herrmann, Wolfgang A.; Kühn, Fritz E.","Synthesis and Characterization of Novel Iron(II) Complexes with Tetradentate Bis(N-heterocyclic carbene)‒Bis(pyridine) (NCCN) Ligands","Organometallics","2012","31","7","2793","","10.1021/om2010673","","","0.71073","MoKα","","0.0474","0.038","","","0.0882","0.0946","","","","","","1.079","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077932","12.2592","0.0004","12.3475","0.0004","13.4771","0.0008","100.749","0.002","105.64","0.002","118.072","0.001","1611.2","0.13","123","1","123","1","","","","","","","","6","P -1","-P 1","2","","","","- C25 H27 F12 Fe N9 P2 -","- C25 H27 F12 Fe N9 P2 -","- C50 H54 F24 Fe2 N18 P4 -","2","1","","Raba, Andreas; Cokoja, Mirza; Ewald, Stefan; Riener, Korbinian; Herdtweck, Eberhardt; Pöthig, Alexander; Herrmann, Wolfgang A.; Kühn, Fritz E.","Synthesis and Characterization of Novel Iron(II) Complexes with Tetradentate Bis(N-heterocyclic carbene)‒Bis(pyridine) (NCCN) Ligands","Organometallics","2012","31","7","2793","","10.1021/om2010673","","","0.71073","MoKα","","0.0342","0.0301","","","0.0767","0.0801","","","","","","1.028","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077933","11.5615","0.0002","12.491","0.0003","13.2661","0.0003","87.9783","0.0008","76.8642","0.0008","63.4836","0.0007","1664.61","0.06","123","","123","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H21 F12 Fe N7 O P2 -","- C22 H21 F12 Fe N7 O P2 -","- C44 H42 F24 Fe2 N14 O2 P4 -","2","1","","Raba, Andreas; Cokoja, Mirza; Ewald, Stefan; Riener, Korbinian; Herdtweck, Eberhardt; Pöthig, Alexander; Herrmann, Wolfgang A.; Kühn, Fritz E.","Synthesis and Characterization of Novel Iron(II) Complexes with Tetradentate Bis(N-heterocyclic carbene)‒Bis(pyridine) (NCCN) Ligands","Organometallics","2012","31","7","2793","","10.1021/om2010673","","x-ray","0.71073","MoKα","","0.0492","0.0362","","","0.0822","0.0859","","","","","","1.042","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077934","12.6283","0.0005","13.172","0.0005","16.6906","0.0008","71.304","0.002","70.488","0.002","70.734","0.002","2400.31","0.18","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H51 B F15 P -","- C51 H51 B F15 P -","- C102 H102 B2 F30 P2 -","2","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0742","0.0537","","","0.1236","0.1371","","","","","","1.021","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077935","11.2833","0.0003","12.7521","0.0004","18.8957","0.0014","97.043","0.002","101.311","0.004","111.568","0.002","2422.2","0.2","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H55 B F15 O P -","- C51 H55 B F15 O P -","- C102 H110 B2 F30 O2 P2 -","2","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0714","0.0593","","","0.156","0.1676","","","","","","1.028","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077936","12.0517","0.0003","16.2929","0.0005","23.8126","0.0007","90","","90","","90","","4675.8","0.2","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C49 H49 B F15 P -","- C49 H49 B F15 P -","- C196 H196 B4 F60 P4 -","4","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0497","0.0486","","","0.1399","0.1412","","","","","","1.023","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077937","11.1241","0.0006","12.3049","0.0007","15.8458","0.0009","104.19","0.005","100.058","0.004","113.002","0.006","1844.6","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H31 B F15 P -","- C40 H31 B F15 P -","- C80 H62 B2 F30 P2 -","2","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0678","0.0488","","","0.1131","0.1275","","","","","","1.046","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077938","10.2366","0.0002","23.1031","0.0005","14.2896","0.0003","90","","90.937","0.001","90","","3379","0.12","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 B F10 P -","- C36 H36 B F10 P -","- C144 H144 B4 F40 P4 -","4","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0787","0.0544","","","0.1265","0.1434","","","","","","1.034","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077939","9.2878","0.0004","12.0852","0.0005","22.1319","0.0011","85.623","0.002","82.11","0.002","81.036","0.002","2426.79","0.19","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H49 B F15 O2 P -","- C52 H49 B F15 O2 P -","- C104 H98 B2 F30 O4 P2 -","2","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0873","0.0571","","","0.1226","0.1413","","","","","","1.025","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077940","11.8807","0.0004","13.8628","0.0003","24.357","0.0007","90","","98.872","0.002","90","","3963.6","0.2","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H29 B Cl2 F15 O2 P -","- C40 H29 B Cl2 F15 O2 P -","- C160 H116 B4 Cl8 F60 O8 P4 -","4","1","","Harhausen, Marcel; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard","Reactions of Modified Intermolecular Frustrated P/B Lewis Pairs with Dihydrogen, Ethene, and Carbon Dioxide","Organometallics","2012","31","7","2801","","10.1021/om201076f","","","1.54178","CuKα","","0.0611","0.0534","","","0.1375","0.1445","","","","","","1.029","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077941","11.1503","0.0001","12.3898","0.0001","23.9191","0.0003","92.8724","0.0004","90.6454","0.0004","113.024","0.0006","3035.65","0.05","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H79 N6 O14 P Pt3 S3 -","- C54 H79 N6 O14 P Pt3 S3 -","- C108 H158 N12 O28 P2 Pt6 S6 -","2","1","","Wieczorek, Birgit; Snelders, Dennis J. M.; Dijkstra, Harm P.; Versluis, Kees; Lutz, Martin; Spek, Anthony L.; Egmond, Maarten R.; Klein Gebbink, Robertus J. M.; van Koten, Gerard","Coordination Chemistry in Water of a Free and a Lipase-Embedded Cationic NCN-Pincer Platinum Center with Neutral and Ionic Triarylphosphines","Organometallics","2012","31","7","2810","","10.1021/om2010832","","","0.71073","MoKα","","0.0548","0.0339","","","0.064","0.0701","","","","","","1.034","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077942","9.174","0.0001","10.3943","0.0001","11.6317","0.0001","64.7206","0.0006","87.9559","0.0005","83.6656","0.0006","996.745","0.018","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H26 F3 N3 O4 Pt S -","- C15 H26 F3 N3 O4 Pt S -","- C30 H52 F6 N6 O8 Pt2 S2 -","2","1","","Wieczorek, Birgit; Snelders, Dennis J. M.; Dijkstra, Harm P.; Versluis, Kees; Lutz, Martin; Spek, Anthony L.; Egmond, Maarten R.; Klein Gebbink, Robertus J. M.; van Koten, Gerard","Coordination Chemistry in Water of a Free and a Lipase-Embedded Cationic NCN-Pincer Platinum Center with Neutral and Ionic Triarylphosphines","Organometallics","2012","31","7","2810","","10.1021/om2010832","","","0.71073","MoKα","","0.0308","0.0304","","","0.081","0.0812","","","","","","1.111","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077943","9.072","0.0002","12.085","0.0003","32.693","0.0009","90","","90","","90","","3584.3","0.15","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C37 H39 Cl2 F6 N2 P Ru2 -","- C37 H39 Cl2 F6 N2 P Ru2 -","- C148 H156 Cl8 F24 N8 P4 Ru8 -","4","1","","Djukic, Jean-Pierre; Sortais, Jean-Baptiste; Barloy, Laurent; Pannetier, Nicolas; Sirlin, Claude; Pfeffer, Michel","Synthesis, Characterization, and Fluxional Behavior of a 34 Electron Homochiral Dimetallic Complex with an Unsupported Hydride Bridge between Two Ru Atoms","Organometallics","2012","31","7","2821","","10.1021/om201093y","","","0.71073","MoKα","","0.0578","0.0378","","","0.0707","0.077","","","","","","1.032","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077944","11.2294","0.0004","15.0015","0.0008","20.9173","0.001","90","","111.534","0.003","90","","3277.7","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H23 Cl N2 Ni -","- C15 H23 Cl N2 Ni -","- C120 H184 Cl8 N16 Ni8 -","8","2","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.1789","0.0569","","","0.1249","0.1904","","","","","","0.936","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077945","8.5246","0.0005","11.9988","0.0009","12.1499","0.0009","102.649","0.004","106.289","0.004","109.1","0.004","1058.98","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 I N2 Ni -","- C21 H27 I N2 Ni -","- C42 H54 I2 N4 Ni2 -","2","1","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.08","0.0441","","","0.0947","0.1271","","","","","","1.086","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077946","8.1838","0.0002","10.9585","0.0005","15.6694","0.0007","99.404","0.002","91.338","0.002","108.408","0.002","1311.22","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H33 I N2 Ni -","- C24 H33 I N2 Ni -","- C48 H66 I2 N4 Ni2 -","2","1","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.0579","0.0412","","","0.1081","0.1153","","","","","","1.061","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077947","12.7615","0.0003","13.5249","0.0005","15.9132","0.0006","90","","105.607","0.002","90","","2645.32","0.16","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H37 I N2 Ni -","- C26 H37 I N2 Ni -","- C104 H148 I4 N8 Ni4 -","4","1","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.0646","0.0389","","","0.0931","0.1197","","","","","","1.088","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077948","9.9126","0.0005","14.0043","0.0004","21.5414","0.001","90","","104.799","0.002","90","","2891.2","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H43 I N2 Ni -","- C29 H43 I N2 Ni -","- C116 H172 I4 N8 Ni4 -","4","1","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.1454","0.0694","","","0.1808","0.225","","","","","","1.056","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077949","13.1632","0.0007","10.3986","0.0007","10.5106","0.0005","90","","106.876","0.003","90","","1376.72","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 Cl N2 Ni -","- C13 H19 Cl N2 Ni -","- C52 H76 Cl4 N8 Ni4 -","4","1","","Oertel, Anna Magdalena; Ritleng, Vincent; Chetcuti, Michael J.","Synthesis and Catalytic Activity in Suzuki Coupling of Nickel Complexes Bearingn-Butyl- and Triethoxysilylpropyl-Substituted NHC Ligands: Toward the Heterogenization of Molecular Catalysts","Organometallics","2012","31","7","2829","","10.1021/om201101g","","","0.71073","MoKα","","0.0426","0.0315","","","0.0711","0.083","","","","","","1.084","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077950","10.79","0.005","11.048","0.005","14.823","0.005","68.657","0.005","85.234","0.005","64.677","0.005","1482.1","1.1","293","2","293","2","","","","","","","","9","P 1","P 1","1","","","","- C28 H28 Cu F6 Fe N3 O2 P S -","- C28 H28 Cu F6 Fe N3 O2 P S -","- C56 H56 Cu2 F12 Fe2 N6 O4 P2 S2 -","2","2","","Goswami, Tridib K.; Gadadhar, Sudarshan; Roy, Mithun; Nethaji, Munirathinam; Karande, Anjali A.; Chakravarty, Akhil R.","Ferrocene-Conjugated Copper(II) Complexes ofl-Methionine and Phenanthroline Bases: Synthesis, Structure, and Photocytotoxic Activity","Organometallics","2012","31","8","3010","","10.1021/om201102k","","","0.71073","MoKα","","0.0712","0.0538","","","0.1333","0.1457","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077951","7.4256","0.0007","11.2727","0.001","29.133","0.003","90","","90","","90","","2438.6","0.4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 Cl Cu N3 O6 S -","- C24 H24 Cl Cu N3 O6 S -","- C96 H96 Cl4 Cu4 N12 O24 S4 -","4","1","","Goswami, Tridib K.; Gadadhar, Sudarshan; Roy, Mithun; Nethaji, Munirathinam; Karande, Anjali A.; Chakravarty, Akhil R.","Ferrocene-Conjugated Copper(II) Complexes ofl-Methionine and Phenanthroline Bases: Synthesis, Structure, and Photocytotoxic Activity","Organometallics","2012","31","8","3010","","10.1021/om201102k","","","0.71073","MoKα","","0.1552","0.0613","","","0.1449","0.1905","","","","","","0.861","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077952","9.6549","0.0007","13.804","0.001","28.1935","0.0019","90","","90","","90","","3757.5","0.5","103","2","103","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C40 H43 I N O4 P Pd -","- C40 H43 I N O4 P Pd -","- C160 H172 I4 N4 O16 P4 Pd4 -","4","1","","Xu, Chang; Jun Hao Kennard, Gan; Hennersdorf, Felix; Li, Yongxin; Pullarkat, Sumod A.; Leung, Pak-Hing","Chiral Phosphapalladacycles as Efficient Catalysts for the Asymmetric Hydrophosphination of Substituted Methylidenemalonate Esters: Direct Access to Functionalized Tertiary Chiral Phosphines","Organometallics","2012","31","8","3022","","10.1021/om201115n","","","0.71073","MoKα","","0.1074","0.0557","","","0.112","0.1495","","","","","","1.006","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077953","26.3695","0.0018","18.7072","0.0011","17.5347","0.0012","90","","122.045","0.003","90","","7331.9","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H54 Cl2 Cr P2 Pd -","- C36 H54 Cl2 Cr P2 Pd -","- C288 H432 Cl16 Cr8 P16 Pd8 -","8","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0683","0.0458","","","0.1471","0.1779","","","","","","0.822","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077954","10.899","0.002","11.419","0.003","16.198","0.003","86.53","0.007","70.774","0.008","67.328","0.006","1751.3","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H38 Cl2 Cr O P2 Pt -","- C40 H38 Cl2 Cr O P2 Pt -","- C80 H76 Cl4 Cr2 O2 P4 Pt2 -","2","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0762","0.0675","","","0.1713","0.1779","","","","","","1.064","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077955","26.131","0.003","18.699","0.002","17.4977","0.0018","90","","120.951","0.002","90","","7332.4","1.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H54 Cl2 Cr P2 Pt -","- C36 H54 Cl2 Cr P2 Pt -","- C288 H432 Cl16 Cr8 P16 Pt8 -","8","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0745","0.0341","","","0.0671","0.0754","","","","","","0.969","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077956","11.268","0.0014","16.9992","0.0018","17.921","0.002","90","","95.335","0.006","90","","3417.8","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H60 Cr P2 Pd -","- C38 H60 Cr P2 Pd -","- C152 H240 Cr4 P8 Pd4 -","4","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0243","0.021","","","0.0505","0.052","","","","","","1.046","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077957","9.3207","0.0005","13.1612","0.0007","15.6194","0.0007","90","","100.521","0.002","90","","1883.84","0.17","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H28 Cr P2 Pt -","- C18 H28 Cr P2 Pt -","- C72 H112 Cr4 P8 Pt4 -","4","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0276","0.0242","","","0.0676","0.081","","","","","","1.23","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077958","12.4993","0.0003","21.686","0.0007","16.6229","0.0005","90","","97.944","0.001","90","","4462.6","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H46 Cr P2 Pt -","- C58 H46 Cr P2 Pt -","- C232 H184 Cr4 P8 Pt4 -","4","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.057","0.0376","","","0.0603","0.0642","","","","","","1.1","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077959","9.8671","0.0019","11.902","0.002","22.483","0.005","87.408","0.011","88.332","0.011","69.159","0.009","2464.8","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H70 Cr P2 Pt -","- C58 H70 Cr P2 Pt -","- C116 H140 Cr2 P4 Pt2 -","2","1","","Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin","Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes","Organometallics","2012","31","8","3027","","10.1021/om201119v","","","0.71073","MoKα","","0.0515","0.0343","","","0.0767","0.0947","","","","","","1.122","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077960","15.7452","0.0016","13.4974","0.0014","21.886","0.002","90","","93.482","0.002","90","","4642.6","0.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H54 B N3 P3 Rh -","- C53 H51 B N3 P3 Rh -","- C212 H204 B4 N12 P12 Rh4 -","4","1","","Tejel, Cristina; Geer, Ana M.; Jiménez, Sonia; López, José A.; Ciriano, Miguel A.","Easy Access to Hydride Chemistry on a Tripodal P-Based Rhodium Scaffold","Organometallics","2012","31","7","2895","","10.1021/om201129j","","","0.71073","MoKα","","0.1202","0.0751","","","0.1271","0.1433","","","","","","1.06","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077961","12.9713","0.001","13.0463","0.001","19.7923","0.0015","80.6362","0.001","76.7235","0.001","79.77","0.001","3182","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C69 H50 B3 D18 F8 N3 P3 Rh -","- C69 H68 B3 F8 N3 P3 Rh -","- C138 H136 B6 F16 N6 P6 Rh2 -","2","1","","Tejel, Cristina; Geer, Ana M.; Jiménez, Sonia; López, José A.; Ciriano, Miguel A.","Easy Access to Hydride Chemistry on a Tripodal P-Based Rhodium Scaffold","Organometallics","2012","31","7","2895","","10.1021/om201129j","","","0.71073","MoKα","","0.0692","0.0438","","","0.098","0.1111","","","","","","1.025","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077962","12.435","0.002","12.972","0.002","14.316","0.003","91.63","0.002","100.044","0.002","114.017","0.002","2064.3","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C102 H98 B2 P6 Rh2 -","- C102 H98 B2 P6 Rh2 -","- C102 H98 B2 P6 Rh2 -","1","0.5","","Tejel, Cristina; Geer, Ana M.; Jiménez, Sonia; López, José A.; Ciriano, Miguel A.","Easy Access to Hydride Chemistry on a Tripodal P-Based Rhodium Scaffold","Organometallics","2012","31","7","2895","","10.1021/om201129j","","","0.71073","MoKα","","0.0915","0.0512","","","0.1045","0.1221","","","","","","0.986","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077963","13.276","0.004","13.764","0.004","26.816","0.008","99.91","0.004","94.923","0.004","116.112","0.006","4261","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C103 H107 B2 P6 Rh2 -","- C103 H93 B2 P6 Rh2 -","- C206 H186 B4 P12 Rh4 -","2","1","","Tejel, Cristina; Geer, Ana M.; Jiménez, Sonia; López, José A.; Ciriano, Miguel A.","Easy Access to Hydride Chemistry on a Tripodal P-Based Rhodium Scaffold","Organometallics","2012","31","7","2895","","10.1021/om201129j","","","0.71073","MoKα","","0.0608","0.0481","","","0.1098","0.1152","","","","","","1.09","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077964","13.313","0.0004","14.9607","0.0005","16.1929","0.0005","91.528","0.002","97.27","0.002","114.749","0.002","2894.02","0.17","119","2","119","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H60 F6 N3 O9 P Pt S2 -","- C48 H60.858 F6 N3 O9.429 P Pt S2 -","- C96 H121.716 F12 N6 O18.858 P2 Pt2 S4 -","2","1","","Zayya, Almas I.; Spencer, John L.","Coordination Chemistry of a Bicyclic 3-Aza-7-phosphabicyclo[3.3.1]nonan-9-one Ligand","Organometallics","2012","31","7","2841","","10.1021/om201131w","","","0.71073","MoKα","","0.0425","0.0315","","","0.0802","0.0843","","","","","","1.04","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077965","15.3563","0.0014","16.5728","0.0013","27.816","0.002","90","","105.768","0.004","90","","6812.7","1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 N3 O5 P Pt -","- C32 H44 N3 O6 P Pt -","- C256 H352 N24 O48 P8 Pt8 -","8","1","","Zayya, Almas I.; Spencer, John L.","Coordination Chemistry of a Bicyclic 3-Aza-7-phosphabicyclo[3.3.1]nonan-9-one Ligand","Organometallics","2012","31","7","2841","","10.1021/om201131w","","","0.71073","MoKα","","0.0693","0.0459","","","0.1023","0.1183","","","","","","1.128","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077966","8.3927","0.0002","11.1631","0.0003","10.8626","0.0002","90","","91.922","0.002","90","","1017.13","0.04","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H30 Cl2 N2 Pd -","- C22 H30 Cl2 N2 Pd -","- C44 H60 Cl4 N4 Pd2 -","2","0.5","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0246","0.0217","","","0.0616","0.0639","","","","","","1.07","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077967","21.404","0.0003","8.8892","0.0002","14.5045","0.0003","90","","90","","90","","2759.69","0.09","173","2","173","2","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C26 H34 Cl2 N2 O4 Pt -","- C26 H34 Cl2 N2 O4 Pt -","- C104 H136 Cl8 N8 O16 Pt4 -","4","","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0313","0.0266","","","0.0712","0.0748","","","","","","1.08","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077968","7.9107","0.0003","18.5383","0.0006","8.6614","0.0003","90","","115.322","0.002","90","","1148.16","0.07","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl2 N2 O4 Pt -","- C22 H30 Cl2 N2 O4 Pt -","- C44 H60 Cl4 N4 O8 Pt2 -","2","0.5","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0375","0.0226","","","0.0496","0.0543","","","","","","1.055","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077969","8.4076","0.0002","9.4946","0.0002","9.5479","0.0002","104.722","0.001","98.402","0.001","113.07","0.001","651.84","0.03","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H38 Cl2 N2 O4 Pt -","- C25.988 H38 Cl2 N2 O3.994 Pt -","- C25.988 H38 Cl2 N2 O3.994 Pt -","1","0.5","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0213","0.0213","","","0.0539","0.0539","","","","","","1.048","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077970","13.295","0.003","13.88","0.003","15.392","0.003","82.38","0.03","67.13","0.03","67.03","0.03","2409","1.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H56 Cl8 N2 O8 Pt -","- C40.003 H56 Cl8 N2 O8 Pt -","- C80.006 H112 Cl16 N4 O16 Pt2 -","2","1","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0749","0.0433","","","0.0939","0.1048","","","","","","0.974","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077971","8.412","0.002","8.542","0.002","15.116","0.004","80.431","0.003","77.45","0.003","65.009","0.002","957.5","0.4","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H24 Cl2 N2 O2 Pt -","- C18 H24 Cl2 N2 O2 Pt -","- C36 H48 Cl4 N4 O4 Pt2 -","2","1","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0173","0.0168","","","0.0439","0.0443","","","","","","1.017","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077972","12.6145","0.0002","12.6662","0.0003","18.3536","0.0005","102.97","0.001","101.277","0.001","112.874","0.001","2498.95","0.1","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C22.44 H32.88 Cl2.88 N2 O2 Pt -","- C22 H32 Cl2 N2 O2 Pt -","- C88 H128 Cl8 N8 O8 Pt4 -","4","2","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0617","0.049","","","0.1421","0.1526","","","","","","1.061","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077973","8.91","0.003","9.003","0.004","24.747","0.009","87.55","0.03","87.042","0.019","60.496","0.016","1725.1","1.2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H50 Cl4 N2 O2 Pt -","- C31 H50 Cl4 N2 O2 Pt -","- C62 H100 Cl8 N4 O4 Pt2 -","2","1","","Zeits, Paul D.; Rachiero, Giovanni Pietro; Hampel, Frank; Reibenspies, Joseph H.; Gladysz, John A.","Gyroscope-Like Platinum and Palladium Complexes with Trans-Spanning Bis(pyridine) Ligands","Organometallics","2012","31","7","2854","","10.1021/om201145x","","","0.71073","MoKα","","0.0599","0.0378","","","0.0826","0.0914","","","","","","1.027","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077974","17.5842","0.0008","26.4171","0.0013","26.6018","0.0013","88.81","0.001","88.724","0.001","80.675","0.001","12189","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","palladium-thallium carbonylphosphine acetylacetonate","","","- C131.5 H113 O14.5 P6 Pd9 Tl -","- C131.5 H113 O14.5 P6 Pd9 Tl -","- C526 H452 O58 P24 Pd36 Tl4 -","4","2","","Mednikov, Evgueni G.; Vo, Nicky; Fry, Charles G.; Dahl, Lawrence F.","High-Yield Synthesis of PPh3-Ligated Decanuclear Tl‒Pd Cluster, Pd9[Tl(acac)](CO)9(PPh3)6: Comparative Analysis of Tl(I)‒Pd(0) Bonding Connectivities with Known Tl‒Pd Clusters and Resulting Insight Concerning Their Dissimilar Dynamic Solution Behavior","Organometallics","2012","31","7","2878","","10.1021/om201150x","","","0.71073","MoKα","","0.0852","0.0644","","","0.1653","0.1771","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077975","16.6815","0.0005","23.9936","0.0007","30.323","0.0009","107.682","0.002","92.176","0.002","99.572","0.002","11351.7","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","palladium-thallium carbonylphosphine acetylacetonate","","","- C123.2 H99.4 O11.3 P6 Pd9 Tl -","- C122.3 H98.65 O11.3 P6 Pd9 Tl -","- C489.2 H394.6 O45.2 P24 Pd36 Tl4 -","4","2","","Mednikov, Evgueni G.; Vo, Nicky; Fry, Charles G.; Dahl, Lawrence F.","High-Yield Synthesis of PPh3-Ligated Decanuclear Tl‒Pd Cluster, Pd9[Tl(acac)](CO)9(PPh3)6: Comparative Analysis of Tl(I)‒Pd(0) Bonding Connectivities with Known Tl‒Pd Clusters and Resulting Insight Concerning Their Dissimilar Dynamic Solution Behavior","Organometallics","2012","31","7","2878","","10.1021/om201150x","","","1.54178","CuKα","","0.0657","0.0448","","","0.1331","0.1506","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077976","12.3105","0.0013","18.709","0.002","12.5383","0.0013","90","","90","","90","","2887.8","0.5","296","2","296","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C52 H72 Fe4 O8 Si2 Sn2 -","- C52 H72 Fe4 O8 Si2 Sn2 -","- C104 H144 Fe8 O16 Si4 Sn4 -","2","0.25","","Zhu, Bolin; Li, Yuan; Chen, Yunfei; Shi, Wei","Reactions of SnMe2-Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl: Migration of the SnMe2Group","Organometallics","2012","31","8","3035","","10.1021/om201151c","","","0.71073","MoKα","","0.0252","0.0215","","","0.0542","0.0572","","","","","","1.035","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077977","10.2768","0.0012","10.9217","0.0013","15.2369","0.0019","71.693","0.002","76.019","0.002","68.965","0.002","1499.3","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H72 Fe4 O8 Si2 Sn2 -","- C52 H72 Fe4 O8 Si2 Sn2 -","- C52 H72 Fe4 O8 Si2 Sn2 -","1","0.5","","Zhu, Bolin; Li, Yuan; Chen, Yunfei; Shi, Wei","Reactions of SnMe2-Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl: Migration of the SnMe2Group","Organometallics","2012","31","8","3035","","10.1021/om201151c","","","0.71073","MoKα","","0.0479","0.034","","","0.0762","0.1053","","","","","","1.075","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077978","18.851","0.003","8.6931","0.0013","13.46","0.002","90","","106.384","0.002","90","","2116.2","0.6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 Fe2 Ge O4 Sn -","- C18 H20 Fe2 Ge O4 Sn -","- C72 H80 Fe8 Ge4 O16 Sn4 -","4","0.5","","Zhu, Bolin; Li, Yuan; Chen, Yunfei; Shi, Wei","Reactions of SnMe2-Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl: Migration of the SnMe2Group","Organometallics","2012","31","8","3035","","10.1021/om201151c","","","0.71073","MoKα","","0.018","0.0159","","","0.0397","0.0408","","","","","","1.056","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077979","9.1782","0.0019","12.419","0.003","9.2376","0.0019","90","","93.203","0.003","90","","1051.3","0.4","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H20 Fe2 Ge O4 Sn -","- C18 H20 Fe2 Ge O4 Sn -","- C36 H40 Fe4 Ge2 O8 Sn2 -","2","1","","Zhu, Bolin; Li, Yuan; Chen, Yunfei; Shi, Wei","Reactions of SnMe2-Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl: Migration of the SnMe2Group","Organometallics","2012","31","8","3035","","10.1021/om201151c","","","0.71073","MoKα","","0.014","0.0135","","","0.0302","0.0304","","","","","","1.051","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077980","11.2394","0.0003","14.3881","0.0003","15.1528","0.0003","79.185","0.0013","88.732","0.0013","85.516","0.001","2399.45","0.09","150","1","150","1","","","","","","","","8","P -1","-P 1","2","","","","- C56 H50 B F4 Fe N2 O P2 -","- C56 H50 B F4 Fe N2 O P2 -","- C112 H100 B2 F8 Fe2 N4 O2 P4 -","2","1","","Prokopchuk, Demyan E.; Sonnenberg, Jessica F.; Meyer, Nils; Zimmer-De Iuliis, Marco; Lough, Alan J.; Morris, Robert H.","Spectroscopic and DFT Study of Ferraaziridine Complexes Formed in the Transfer Hydrogenation of Acetophenone Catalyzed Usingtrans-[Fe(CO)(NCMe)(PPh2C6H4CH═NCH2−)2-κ4P,N,N,P](BF4)2","Organometallics","2012","31","8","3056","","10.1021/om201170f","","","0.71073","MoKα","","0.1131","0.0675","","","0.1713","0.2009","","","","","","1.05","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077981","6.5377","0.0003","7.7434","0.0003","11.4131","0.0005","83.868","0.002","75.662","0.002","78.727","0.002","547.94","0.04","180","2","180","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C6 Fe2 O6 S2 -","- C6 Fe2 O6 S2 -","- C12 Fe4 O12 S4 -","2","1","","Farrugia, Louis J.; Evans, Cameron; Senn, Hans Martin; Hänninen, Mikko M.; Sillanpää, Reijo","QTAIM View of Metal‒Metal Bonding in Di- and Trinuclear Disulfido Carbonyl Clusters","Organometallics","2012","31","7","2559","","10.1021/om2011744","","x-ray","0.71073","MoKα","","0.0209","0.0178","","","0.0462","0.0476","","","","","","0.929","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077982","6.6959","0.0002","9.0603","0.0003","13.0139","0.0004","93.758","0.002","94.46","0.002","111.078","0.002","730.74","0.04","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C9 Fe3 O9 S2 -","- C9 Fe3 O9 S2 -","- C18 Fe6 O18 S4 -","2","1","","Farrugia, Louis J.; Evans, Cameron; Senn, Hans Martin; Hänninen, Mikko M.; Sillanpää, Reijo","QTAIM View of Metal‒Metal Bonding in Di- and Trinuclear Disulfido Carbonyl Clusters","Organometallics","2012","31","7","2559","","10.1021/om2011744","","x-ray","0.71073","MoKα","","0.0197","0.0174","","","","0.0197","","","","","","2.582","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077983","6.7549","0.0001","9.9824","0.0001","17.0218","0.0002","90","","90","","90","","1147.78","0.02","100","2","100","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 Mn2 O7 S2 -","- C7 Mn2 O7 S2 -","- C28 Mn8 O28 S8 -","4","1","","Farrugia, Louis J.; Evans, Cameron; Senn, Hans Martin; Hänninen, Mikko M.; Sillanpää, Reijo","QTAIM View of Metal‒Metal Bonding in Di- and Trinuclear Disulfido Carbonyl Clusters","Organometallics","2012","31","7","2559","","10.1021/om2011744","","x-ray","0.71073","MoKα","","0.0115","0.0106","","","","0.0112","","","","","","1.47","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077984","7.9801","0.0001","9.4189","0.0001","16.1198","0.0001","91.3361","0.0004","103.439","0.0004","97.8862","0.0004","1165.38","0.02","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C23 H15 Fe2 O5 P S2 -","- C23 H15 Fe2 O5 P S2 -","- C46 H30 Fe4 O10 P2 S4 -","2","1","","Farrugia, Louis J.; Evans, Cameron; Senn, Hans Martin; Hänninen, Mikko M.; Sillanpää, Reijo","QTAIM View of Metal‒Metal Bonding in Di- and Trinuclear Disulfido Carbonyl Clusters","Organometallics","2012","31","7","2559","","10.1021/om2011744","","x-ray","0.71073","MoKα","","0.0229","0.0159","","","","0.0138","","","","","","1.661","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077985","15.859","0.003","9.916","0.002","22.835","0.005","90","","98.16","0.03","90","","3554.6","1.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H58 B20 P2 -","- C20 H58 B20 P2 -","- C80 H232 B80 P8 -","4","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.0821","0.0634","","","0.1408","0.1525","","","","","","1.097","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077986","10.6627","0.0008","14.668","0.0012","14.6944","0.0011","102.288","0.002","109.124","0.001","107.29","0.001","1946.8","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H56 B20 Cl2 P2 Pd2 -","- C20 H56 B20 Cl2 P2 Pd2 -","- C40 H112 B40 Cl4 P4 Pd4 -","2","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.1142","0.0655","","","0.1581","0.1796","","","","","","0.966","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4077987","9.9818","0.0007","19.5741","0.0016","14.1865","0.0012","90","","105.474","0.004","90","","2671.4","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H43 B10 Cl P2 Pd -","- C16 H43 B10 Cl P2 Pd -","- C64 H172 B40 Cl4 P8 Pd4 -","4","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.0566","0.0362","","","0.0612","0.0647","","","","","","0.956","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077988","9.3679","0.0007","35.724","0.004","14.6186","0.0013","90","","96.157","0.007","90","","4864","0.8","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30.75 H66 B20 Cl2 O2 P2 Rh2 -","- C30.75 H66 B20 Cl2 O2 P2 Rh2 -","- C123 H264 B80 Cl8 O8 P8 Rh8 -","4","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.0334","0.026","","","0.0561","0.0585","","","","","","1.064","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077989","9.61","0.004","33.242","0.014","14.348","0.006","90","","98.2","0.02","90","","4537","3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H64 B20 Cl2 O3 P2 Rh2 -","- C26 H64 B20 Cl2 O3 P2 Rh2 -","- C104 H256 B80 Cl8 O12 P8 Rh8 -","4","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.1567","0.0608","","","0.105","0.1325","","","","","","0.975","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077990","9.821","0.005","26.348","0.014","17.811","0.009","90","","102.823","0.009","90","","4494","4","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H57 B20 Cl5 O2 P2 Rh2 -","- C23 H57 B20 Cl5 O2 P2 Rh2 -","- C92 H228 B80 Cl20 O8 P8 Rh8 -","4","1","","Fey, Natalie; Haddow, Mairi F.; Mistry, Rakesh; Norman, Nicholas C.; Orpen, A. Guy; Reynolds, Timothy J.; Pringle, Paul G.","Regioselective B-Cyclometalation of a Bulkyo-Carboranyl Phosphine and the Unexpected Formation of a Dirhodium(II) Complex","Organometallics","2012","31","7","2907","","10.1021/om201198s","","","0.71073","MoKα","","0.0841","0.0481","","","0.102","0.1153","","","","","","0.955","","","","has coordinates,has disorder","178668","2020-10-21","18:00:00",""
"4077991","16.043","0.0005","15.8195","0.0005","16.6513","0.0005","90","","106.478","0.002","90","","4052.4","0.2","90","2","90","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C40 H43 Cl2 Ge N2 O P Ru S4 -","- C40 H43 Cl2 Ge N2 O P Ru S4 -","- C160 H172 Cl8 Ge4 N8 O4 P4 Ru4 S16 -","4","1","","Boyd, Peter D. W.; Hart, Michael C.; Pritzwald-Stegmann, Julian R. F.; Roper, Warren R.; Wright, L. James","Selective Substitution of One of the Substituents on Germanium in Coordinatively Unsaturated Ruthenium Germyl Complexes","Organometallics","2012","31","7","2914","","10.1021/om201239a","","","0.71073","MoKα","","0.0789","0.0422","","","0.0844","0.0964","","","","","","1.004","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077992","10.6616","0.0002","16.7869","0.0003","24.0182","0.0004","90","","100.641","0.001","90","","4224.74","0.13","90","2","90","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C46 H46 Ge N O2 P Ru S2 -","- C46 H46 Ge N O2 P Ru S2 -","- C184 H184 Ge4 N4 O8 P4 Ru4 S8 -","4","1","","Boyd, Peter D. W.; Hart, Michael C.; Pritzwald-Stegmann, Julian R. F.; Roper, Warren R.; Wright, L. James","Selective Substitution of One of the Substituents on Germanium in Coordinatively Unsaturated Ruthenium Germyl Complexes","Organometallics","2012","31","7","2914","","10.1021/om201239a","","","0.71073","MoKα","","0.0323","0.0241","","","0.0563","0.0601","","","","","","1.025","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077993","36.9885","0.0009","12.5842","0.0003","26.2957","0.0006","90","","94.613","0.002","90","","12200.2","0.5","90","2","90","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C64.5 H63 Cl2.38 Ge N O P2 Ru S2 -","- C64.5 H63 Cl2.354 Ge N O P2 Ru S2 -","- C516 H504 Cl18.832 Ge8 N8 O8 P16 Ru8 S16 -","8","1","","Boyd, Peter D. W.; Hart, Michael C.; Pritzwald-Stegmann, Julian R. F.; Roper, Warren R.; Wright, L. James","Selective Substitution of One of the Substituents on Germanium in Coordinatively Unsaturated Ruthenium Germyl Complexes","Organometallics","2012","31","7","2914","","10.1021/om201239a","","","0.71073","MoKα","","0.1389","0.063","","","0.1186","0.1385","","","","","","0.942","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077994","12.9682","0.0002","21.4121","0.0004","18.507","0.0003","90","","95.829","0.001","90","","5112.39","0.15","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C59 H53 Cl3 Ge O P2 Ru -","- C59 H53 Cl3 Ge O P2 Ru -","- C236 H212 Cl12 Ge4 O4 P8 Ru4 -","4","1","","Boyd, Peter D. W.; Hart, Michael C.; Pritzwald-Stegmann, Julian R. F.; Roper, Warren R.; Wright, L. James","Selective Substitution of One of the Substituents on Germanium in Coordinatively Unsaturated Ruthenium Germyl Complexes","Organometallics","2012","31","7","2914","","10.1021/om201239a","","","0.71073","MoKα","","0.0544","0.035","","","0.0723","0.0793","","","","","","1.017","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077995","9.5724","0.0005","9.8981","0.0006","10.3109","0.0005","99.468","0.003","94.966","0.003","101.819","0.003","935.86","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H70 Br2 P2 Pt -","- C32 H70 Br2 P2 Pt -","- C32 H70 Br2 P2 Pt -","1","0.5","","Dub, Pavel A.; Béthegnies, Aurélien; Daran, Jean-Claude; Poli, Rinaldo","Formation and Structure of a Platinum(II) Complex Containing TwotransNonstabilized Phosphorus Ylide Ligands: Evidence for Reversible Ylide Dissociation","Organometallics","2012","31","8","3081","","10.1021/om2012453","","","0.71073","MoKα","","0.078","0.0642","","","0.1641","0.1771","","","","","","1.088","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077996","16.7705","0.0012","17.5056","0.0015","16.2008","0.0012","90","","90","","90","","4756.2","0.6","125","","125","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H23 Br Sn -","- C30 H23 Br Sn -","- C240 H184 Br8 Sn8 -","8","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0359","","","","0.0783","","","","","","1.125","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077997","9.127","0.002","16.587","0.004","14.9","0.003","90","","93.06","0.013","90","","2252.5","0.9","125","","125","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Br Cl Sn -","- C24 H18 Br Cl Sn -","- C96 H72 Br4 Cl4 Sn4 -","4","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0753","","","","0.253","","","","","","1.104","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077998","10.073","0.005","11.839","0.004","12.381","0.006","90.697","0.01","109.926","0.012","95.247","0.009","1380.8","1.1","93","","93","","","","","","","","","4","P -1","-P 1","2","","","","- C36 H26 Br2 Sn -","- C36 H26 Br2 Sn -","- C72 H52 Br4 Sn2 -","2","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0512","","","","0.1396","","","","","","1.087","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4077999","12.467","0.003","9.2962","0.0018","26.334","0.006","90","","91.477","0.006","90","","3051","1.2","125","","125","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 Br2 Sn -","- C38 H30 Br2 Sn -","- C152 H120 Br8 Sn4 -","4","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0504","","","","0.1635","","","","","","1.152","","","","has coordinates","178668","2020-10-21","18:00:00",""
"4078000","7.601","0.003","15.347","0.007","16.066","0.007","102.2","0.011","92.613","0.01","100.486","0.01","1794.3","1.3","93","","93","","","","","","","","","4","P -1","-P 1","2","","","","- C44 H43 Br3 Sn -","- C44 H43 Br3 Sn -","- C88 H86 Br6 Sn2 -","2","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0633","","","","0.1564","","","","","","1.225","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078001","7.198","0.006","10.31","0.007","18.692","0.014","81.51","0.03","87.91","0.02","74.413","0.015","1321.5","1.7","125","","125","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 Br2 Cl2 O Sn -","- C28 H24 Br2 Cl2 O Sn -","- C56 H48 Br4 Cl4 O2 Sn2 -","2","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.0498","","","","0.1443","","","","","","1.127","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078002","8.601","0.004","11.173","0.005","12.711","0.008","75.78","0.04","85.23","0.06","68.82","0.05","1104.1","1.1","125","","125","","","","","","","","","6","P -1","-P 1","2","","","","- C23 H23 Br Cl2 O Sn -","- C23 H23 Br Cl2 O Sn -","- C46 H46 Br2 Cl4 O2 Sn2 -","2","1","","Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek","Sterically Crowded Tin Acenaphthenes","Organometallics","2012","31","7","2922","","10.1021/om201253t","","","0.71075","MoKα","","","0.1005","","","","0.363","","","","","","1.377","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078003","24.153","0.0006","24.153","0.0006","16.6932","0.0008","90","","90","","120","","8433.6","0.5","100","2","100","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C43 H63 Au Cl2 F6 N2 P3 Sb -","- C43 H63 Au Cl2 F6 N2 P3 Sb -","- C258 H378 Au6 Cl12 F36 N12 P18 Sb6 -","6","0.5","","Townsend, Nell S.; Green, Michael; Russell, Christopher A.","Cationic Gold(I) Complexes of 2,4,6-Tri-tert-butyl-1,3,5-triphosphabenzene","Organometallics","2012","31","7","2543","","10.1021/om201265n","","","0.71073","MoKα","","0.0972","0.0646","","","0.1738","0.1976","","","","","","1.063","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078004","12.9395","0.0003","13.1635","0.0003","14.1076","0.0004","80.828","0.001","87.791","0.001","64.854","0.001","2146.25","0.09","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H56 Au Cl2 F6 P4 Sb -","- C36 H56 Au Cl2 F6 P4 Sb -","- C72 H112 Au2 Cl4 F12 P8 Sb2 -","2","1","","Townsend, Nell S.; Green, Michael; Russell, Christopher A.","Cationic Gold(I) Complexes of 2,4,6-Tri-tert-butyl-1,3,5-triphosphabenzene","Organometallics","2012","31","7","2543","","10.1021/om201265n","","","0.71073","MoKα","","0.0324","0.027","","","0.0609","0.0633","","","","","","1.026","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078005","23.8478","0.0011","15.9582","0.0008","14.1111","0.0007","90","","102.063","0.001","90","","5251.6","0.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H76 Al2 B2 Mg2 N12 -","- C45 H76 Al2 B2 Mg2 N12 -","- C180 H304 Al8 B8 Mg8 N48 -","4","1","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.05","0.0431","","","0.1176","0.1234","","","","","","1.027","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078006","19.1953","0.0002","13.3301","0.0007","7.803","0.0005","90","","90","","90","","1996.59","0.17","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H25 B Mg N6 -","- C16 H25 B Mg N6 -","- C64 H100 B4 Mg4 N24 -","4","0.5","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0729","0.0677","","","0.1494","0.1515","","","","","","1.356","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078007","22.402","0.004","22.402","0.004","22.402","0.004","90","","90","","90","","11242","3","123","2","123","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C25 H43 B Mg N6 -","- C25 H43 B Mg N6 -","- C400 H688 B16 Mg16 N96 -","16","0.333333","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0345","0.0297","","","0.0761","0.0806","","","","","","1.064","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078008","8.2803","0.0012","15.095","0.002","15.892","0.003","80.445","0.013","83.399","0.012","87.613","0.012","1945.3","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H34 Mg O2 -","- C19 H34 Mg O2 -","- C76 H136 Mg4 O8 -","4","2","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.1233","0.0853","","","0.2001","0.222","","","","","","1.056","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078009","13.1949","0.0008","13.1949","0.0008","32.321","0.003","90","","90","","120","","4873.4","0.6","173","2","173","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C24 H60 Al3 Ba K -","- C24 H60 Al3 Ba K -","- C144 H360 Al18 Ba6 K6 -","6","0.333333","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0411","0.0394","","","0.1033","0.1041","","","","","","1.19","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078010","7.3108","0.0004","7.3108","0.0004","17.6876","0.0013","90","","90","","120","","818.71","0.09","173","2","173","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C8 H20 Al K -","- C8 H20 Al K -","- C24 H60 Al3 K3 -","3","0.5","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0229","0.0223","","","0.0558","0.0561","","","","","","1.173","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078011","18.6952","0.001","13.6002","0.0007","20.7781","0.0011","90","","97.601","0.001","90","","5236.6","0.5","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H56 B2 Ca N12 -","- C60 H56 B2 Ca N12 -","- C240 H224 B8 Ca4 N48 -","4","0.5","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0413","0.0338","","","0.0848","0.0896","","","","","","1.037","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078012","10.4073","0.0013","11.6229","0.0016","17.287","0.002","95.408","0.01","96.536","0.01","111.819","0.01","1907.4","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H56 B Ba N7 O2 Si2 -","- C29 H56 B Ba N7 O2 Si2 -","- C58 H112 B2 Ba2 N14 O4 Si4 -","2","1","","Michel, Olaf; Dietrich, H. Martin; Litlabø, Rannveig; Törnroos, Karl W.; Maichle-Mössmer, Cäcilia; Anwander, Reiner","Tris(pyrazolyl)borate Complexes of the Alkaline-Earth Metals: Alkylaluminate Precursors and Schlenk-Type Rearrangements","Organometallics","2012","31","8","3119","","10.1021/om300032c","","","0.71073","MoKα","","0.0832","0.0659","","","0.1016","0.106","","","","","","1.214","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4078013","11.4001","0.0006","14.0634","0.0006","15.5159","0.0009","90","","93.681","0.005","90","","2482.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H29 O7 P Pd S -","- C23 H29 O7 P Pd S -","- C92 H116 O28 P4 Pd4 S4 -","4","1","","Neuwald, Boris; Ölscher, Franz; Göttker-Schnetmann, Inigo; Mecking, Stefan","Limits of Activity: Weakly Coordinating Ligands in Arylphosphinesulfonato Palladium(II) Polymerization Catalysts","Organometallics","2012","31","8","3128","","10.1021/om3000339","","","0.71073","MoKα","","0.0346","0.027","","","0.0571","0.0594","","","","","","1.046","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078014","12.0993","0.0008","12.0348","0.0008","13.4363","0.0008","77.079","0.005","69.231","0.005","75.256","0.005","1749.8","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H48 O6 P2 Pd S -","- C33 H48 O6 P2 Pd S -","- C66 H96 O12 P4 Pd2 S2 -","2","1","","Neuwald, Boris; Ölscher, Franz; Göttker-Schnetmann, Inigo; Mecking, Stefan","Limits of Activity: Weakly Coordinating Ligands in Arylphosphinesulfonato Palladium(II) Polymerization Catalysts","Organometallics","2012","31","8","3128","","10.1021/om3000339","","","0.71073","MoKα","","0.0581","0.0394","","","0.0759","0.0811","","","","","","0.986","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078015","14.2186","0.0005","10.622","0.0005","29.5485","0.0012","90","","115.328","0.003","90","","4033.7","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H37 Cl3 O6 P2 Pd S -","- C40 H37 Cl3 O6 P2 Pd S -","- C160 H148 Cl12 O24 P8 Pd4 S4 -","4","1","","Neuwald, Boris; Ölscher, Franz; Göttker-Schnetmann, Inigo; Mecking, Stefan","Limits of Activity: Weakly Coordinating Ligands in Arylphosphinesulfonato Palladium(II) Polymerization Catalysts","Organometallics","2012","31","8","3128","","10.1021/om3000339","","","0.71073","MoKα","","0.0647","0.0459","","","0.0971","0.1036","","","","","","1.033","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078016","11.592","0.002","16.191","0.003","20.505","0.004","90","","92.07","0.03","90","","3846","1.2","198","","198","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H44 Au2 N14 O2 -","- C34 H44 Au2 N14 O2 -","- C136 H176 Au8 N56 O8 -","4","0.5","","Poethig, Alexander; Strassner, Thomas","Triazinone-Bridged Neutral Dinuclear Gold(I)-NHC Complex","Organometallics","2012","31","8","3431","","10.1021/om3000345","","x-ray","0.71073","MoKα","","0.0558","0.0365","","","0.0686","0.0723","","","","","","1.054","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078017","11.994","0.0009","13.134","0.0011","15.5174","0.0013","88.399","0.004","82.988","0.004","87.902","0.005","2423.9","0.3","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H142 La2 N4 O4 -","- C106 H142 La2 N4 O4 -","- C106 H142 La2 N4 O4 -","1","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.119","0.0883","","","0.1928","0.2137","","","","","","1.055","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078018","11.9744","0.001","13.1231","0.0011","15.3787","0.0014","88.044","0.005","82.648","0.005","88.124","0.005","2394.4","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C106 H142 N4 Nd2 O4 -","- C106 H142 N4 Nd2 O4 -","- C106 H142 N4 Nd2 O4 -","1","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0763","0.0637","","","0.1416","0.1493","","","","","","1.08","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078019","12.437","0.0007","20.8532","0.0011","15.5541","0.0009","90","","110.397","0.001","90","","3781","0.4","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H110 La2 N4 O4 Si4 -","- C70 H94 La2 N4 O4 Si4 -","- C140 H188 La4 N8 O8 Si8 -","2","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0662","0.0576","","","0.1346","0.1398","","","","","","1.109","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078020","12.3331","0.0009","20.8502","0.0014","15.5922","0.0012","90","","110.702","0.002","90","","3750.6","0.5","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H110 N4 Nd2 O4 Si4 -","- C70 H94 N4 Nd2 O4 Si4 -","- C140 H188 N8 Nd4 O8 Si8 -","2","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0529","0.0449","","","0.1015","0.1062","","","","","","1.118","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078021","12.3059","0.0012","20.8517","0.0015","15.6013","0.0014","90","","110.752","0.002","90","","3743.6","0.6","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H110 N4 O4 Si4 Sm2 -","- C70 H94 N4 O4 Si4 Sm2 -","- C140 H188 N8 O8 Si8 Sm4 -","2","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0633","0.0532","","","0.1117","0.1166","","","","","","1.145","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078022","10.0939","0.0016","14.244","0.003","15.441","0.003","108.887","0.003","92.534","0.003","101.661","0.003","2042.7","0.7","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H120 La2 N6 O4 Si4 -","- C74 H104 La2 N6 O4 Si4 -","- C74 H104 La2 N6 O4 Si4 -","1","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0555","0.0476","","","0.1197","0.1246","","","","","","1.071","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078023","10.1002","0.0012","14.162","0.002","15.343","0.002","108.345","0.002","92.086","0.002","102.169","0.002","2023.8","0.5","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H120 N6 Nd2 O4 Si4 -","- C74 H104 N6 Nd2 O4 Si4 -","- C74 H104 N6 Nd2 O4 Si4 -","1","0.5","","Zhang, Jie; Qiu, Jinshui; Yao, Yingming; Zhang, Yong; Wang, Yaorong; Shen, Qi","Synthesis and Characterization of Lanthanide Amides Bearing Aminophenoxy Ligands and Their Catalytic Activity for the Polymerization of Lactides","Organometallics","2012","31","8","3138","","10.1021/om300036a","","","0.71075","MoKα","","0.0449","0.0403","","","0.1011","0.1042","","","","","","1.074","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078024","23.395","0.007","9.136","0.002","21.741","0.006","90","","103.653","0.003","90","","4516","2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C55 H44 B Cl2 P3 -","- C55 H44 B Cl2 P3 -","- C220 H176 B4 Cl8 P12 -","4","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal–Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.0895","0.0754","","","0.1541","0.1606","","","","","","1.202","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078025","13.09","0.002","17.27","0.003","19.61","0.003","90","","96.43","0.002","90","","4405.2","1.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H43 B O P3 Rh -","- C55 H43 B O P3 Rh -","- C220 H172 B4 O4 P12 Rh4 -","4","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.1008","0.0821","","","0.1847","0.199","","","","","","1.199","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078026","12.262","0.002","13.88","0.003","17.753","0.004","104.11","0.004","91.71","0.004","107.707","0.005","2773.8","1","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H48 B2 Cl6 F4 O P3 Rh -","- C58 H48 B2 Cl6 F4 O P3 Rh -","- C116 H96 B4 Cl12 F8 O2 P6 Rh2 -","2","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.116","0.0825","","","0.2179","0.2349","","","","","","1.075","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078027","12.3787","0.0005","19.3806","0.0009","21.4296","0.001","90","","91.619","0.003","90","","5139.1","0.4","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C59 H53 B F4 O2 P3 Rh -","- C59 H53 B F4 O2 P3 Rh -","- C236 H212 B4 F16 O8 P12 Rh4 -","4","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.0796","0.0691","","","0.1687","0.1755","","","","","","1.135","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078028","13.947","0.003","14.296","0.003","19.759","0.004","88.517","0.004","88.374","0.004","97.966","0.005","3898.3","1.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C83 H101 K O11 P3 Rh -","- C83 H101 K O11 P3 Rh -","- C166 H202 K2 O22 P6 Rh2 -","2","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.0787","0.0658","","","0.156","0.1642","","","","","","1.077","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078029","42.511","0.003","11.9549","0.0007","21.7612","0.0015","90","","108.636","0.003","90","","10479.5","1.2","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C63 H58 B P4 Rh -","- C63 H58 B P4 Rh -","- C504 H464 B8 P32 Rh8 -","8","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.088","0.068","","","0.1437","0.1516","","","","","","1.159","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078030","26.936","0.002","14.505","0.0009","26.8422","0.0019","90","","98.819","0.004","90","","10363.4","1.2","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C112 B K O20 P4 Rh -","- C112 B K O20 P4 Rh -","- C448 B4 K4 O80 P16 Rh4 -","4","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Rhodaboratranes Bearing Phosphine-Tethered Boranes: Evaluation of the Metal‒Boron Interaction","Organometallics","2012","31","8","3155","","10.1021/om3000423","","","0.7107","MoKα","","0.171","0.164","","","0.4275","0.436","","","","","","1.954","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078031","9.711","0.008","9.862","0.008","21.302","0.018","83.024","0.01","76.924","0.01","82.917","0.01","1963","3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H39 O5 P3 W -","- C45 H39 O5 P3 W -","- C90 H78 O10 P6 W2 -","2","1","","Kyran, Samuel J.; Muhammad, Sohail; Knestrick, Matthew; Bengali, Ashfaq A.; Darensbourg, Donald J.","Photochemically Generated Transients from κ2- and κ3-Triphos Derivatives of Group 6 Metal Carbonyls and Their Reactivity with Olefins","Organometallics","2012","31","8","3163","","10.1021/om300044k","","","0.71073","MoKα","","0.0957","0.0635","","","0.1705","0.2043","","","","","","1.084","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078032","9.735","0.006","9.906","0.006","21.266","0.013","82.99","0.007","76.863","0.007","83.283","0.007","1974","2","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H39 Mo O5 P3 -","- C45 H39 Mo O5 P3 -","- C90 H78 Mo2 O10 P6 -","2","1","","Kyran, Samuel J.; Muhammad, Sohail; Knestrick, Matthew; Bengali, Ashfaq A.; Darensbourg, Donald J.","Photochemically Generated Transients from κ2- and κ3-Triphos Derivatives of Group 6 Metal Carbonyls and Their Reactivity with Olefins","Organometallics","2012","31","8","3163","","10.1021/om300044k","","","0.71073","MoKα","","0.0549","0.04","","","0.0946","0.1021","","","","","","1.067","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078033","16.9778","0.0006","18.8108","0.0007","10.5559","0.0004","90","","90","","90","","3371.2","0.2","150","2","150","2","","","","","","","","8","P 21 21 2","P 2 2ab","18","","","","- C24 H38 Cl2 Cu F6 N7 O P2 -","- C24 H38 Cl2 Cu F6 N7 O P2 -","- C96 H152 Cl8 Cu4 F24 N28 O4 P8 -","4","1","","Tazelaar, Cornelis G. J.; Lyaskovskyy, Volodymyr; Dijk, Tom van; Broere, Daniël L. J.; Kolfschoten, Ludo A.; Khiar, Rima Osman Hassan; Lutz, Martin; Slootweg, J. Chris; Lammertsma, Koop","Tris(pyrazolyl)phosphine Oxides. Synthesis and Coordination Chemistry with Copper(I)","Organometallics","2012","31","8","3308","","10.1021/om300051f","","","0.71073","MoKα","","0.0337","0.0326","","","0.0925","0.0936","","","","","","1.023","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078034","8.612","0.0003","23.4829","0.0009","17.3556","0.0006","90","","109.357","0.002","90","","3311.5","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Cu F6 N7 O P2 -","- C32 H30 Cu F6 N7 O P2 -","- C128 H120 Cu4 F24 N28 O4 P8 -","4","1","","Tazelaar, Cornelis G. J.; Lyaskovskyy, Volodymyr; Dijk, Tom van; Broere, Daniël L. J.; Kolfschoten, Ludo A.; Khiar, Rima Osman Hassan; Lutz, Martin; Slootweg, J. Chris; Lammertsma, Koop","Tris(pyrazolyl)phosphine Oxides. Synthesis and Coordination Chemistry with Copper(I)","Organometallics","2012","31","8","3308","","10.1021/om300051f","","","0.71073","MoKα","","0.0337","0.0294","","","0.0761","0.0795","","","","","","1.032","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4078035","11.0739","0.0003","12.6624","0.0003","15.9619","0.0002","102.223","0.001","106.463","0.001","91.278","0.001","2089.69","0.08","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H40 Cl4 Cu F6 N6 O P3 -","- C35 H40 Cl4 Cu F6 N6 O P3 -","- C70 H80 Cl8 Cu2 F12 N12 O2 P6 -","2","1","","Tazelaar, Cornelis G. J.; Lyaskovskyy, Volodymyr; Dijk, Tom van; Broere, Daniël L. J.; Kolfschoten, Ludo A.; Khiar, Rima Osman Hassan; Lutz, Martin; Slootweg, J. Chris; Lammertsma, Koop","Tris(pyrazolyl)phosphine Oxides. Synthesis and Coordination Chemistry with Copper(I)","Organometallics","2012","31","8","3308","","10.1021/om300051f","","","0.71073","MoKα","","0.0409","0.0349","","","0.0887","0.0937","","","","","","1.032","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4078036","37.7276","0.001","12.0382","0.0003","14.8599","0.0004","90","","108.999","0.003","90","","6381.3","0.3","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C35 H40 Cl2 N2 O Ru -","- C35 H40 Cl2 N2 O Ru -","- C280 H320 Cl16 N16 O8 Ru8 -","8","2","","Barbasiewicz, Michał; Grudzień, Krzysztof; Malinska, Maura","A Missing Relative: A Hoveyda‒Grubbs Metathesis Catalyst Bearing a Peri-Substituted Naphthalene Framework","Organometallics","2012","31","8","3171","","10.1021/om300052b","","","0.71073","","","0.0388","0.0352","","","0.0956","0.0972","","","","","","1.202","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078037","4.9018","0.0003","7.7798","0.0005","21.9948","0.0016","90","","90","","90","","838.77","0.1","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C44 H40 O8 -","4","1","","Barbasiewicz, Michał; Grudzień, Krzysztof; Malinska, Maura","A Missing Relative: A Hoveyda–Grubbs Metathesis Catalyst Bearing a Peri-Substituted Naphthalene Framework","Organometallics","2012","31","8","3171","","10.1021/om300052b","","","0.71073","MoKα","","0.0365","0.0293","","","0.069","0.0721","","","","","","1.129","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078038","12.789","0.005","20.362","0.005","17.377","0.005","90","","94.277","0.005","90","","4513","2","100","","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","complex-2","","","- C84 H136 Ba2 I2 K2 N4 O8 -","- C84 H136 Ba2 I2 K2 N4 O8 -","- C168 H272 Ba4 I4 K4 N8 O16 -","2","0.5","","Panda, Tarun K.; Kaneko, Hiroshi; Michel, Olaf; Pal, Kuntal; Tsurugi, Hayato; Törnroos, Karl W.; Anwander, Reiner; Mashima, Kazushi","Dianion and Monoanion Ligation of 1,4-Diaza-1,3-butadiene to Barium, Strontium, and Calcium","Organometallics","2012","31","8","3178","","10.1021/om300054h","","x-ray","0.71073","MoKα","","0.1248","0.0741","","","0.1672","0.2287","","","","","","1.119","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078039","11.4776","0.0011","12.6463","0.0012","15.0886","0.0014","91.955","0.008","100.815","0.007","115.211","0.007","1930.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","complex-3","","","- C74 H110 Ba2 I2 N4 O4 -","- C74 H110 Ba2 I2 N4 O4 -","- C74 H110 Ba2 I2 N4 O4 -","1","0.5","","Panda, Tarun K.; Kaneko, Hiroshi; Michel, Olaf; Pal, Kuntal; Tsurugi, Hayato; Törnroos, Karl W.; Anwander, Reiner; Mashima, Kazushi","Dianion and Monoanion Ligation of 1,4-Diaza-1,3-butadiene to Barium, Strontium, and Calcium","Organometallics","2012","31","8","3178","","10.1021/om300054h","","","0.71073","MoKα","","0.0658","0.0473","","","0.0938","0.0992","","","","","","1.202","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078040","13.662","0.005","17.422","0.005","19.213","0.004","90","","115.621","0.017","90","","4123","2","100","","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","complex-4","","","- C83 H135 N4 O8 Sr2 -","- C83 H135 N4 O8 Sr2 -","- C166 H270 N8 O16 Sr4 -","2","0.5","","Panda, Tarun K.; Kaneko, Hiroshi; Michel, Olaf; Pal, Kuntal; Tsurugi, Hayato; Törnroos, Karl W.; Anwander, Reiner; Mashima, Kazushi","Dianion and Monoanion Ligation of 1,4-Diaza-1,3-butadiene to Barium, Strontium, and Calcium","Organometallics","2012","31","8","3178","","10.1021/om300054h","","x-ray","0.71073","MoKα","","0.2126","0.0956","","","0.2312","0.2494","","","","","","1.035","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078041","9.9117","0.0006","30.9715","0.0019","16.2712","0.001","90","","99.901","0.001","90","","4920.5","0.5","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","complex-5","","","- C50 H84 Ca N2 O6 -","- C50 H84 Ca N2 O6 -","- C200 H336 Ca4 N8 O24 -","4","1","","Panda, Tarun K.; Kaneko, Hiroshi; Michel, Olaf; Pal, Kuntal; Tsurugi, Hayato; Törnroos, Karl W.; Anwander, Reiner; Mashima, Kazushi","Dianion and Monoanion Ligation of 1,4-Diaza-1,3-butadiene to Barium, Strontium, and Calcium","Organometallics","2012","31","8","3178","","10.1021/om300054h","","","0.71073","MoKα","","0.0811","0.0622","","","0.1588","0.1688","","","","","","1.083","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078042","10.2762","0.0008","11.2916","0.0009","16.744","0.0013","83.727","0.002","72.795","0.002","80.446","0.002","1826.5","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H40 B Ir N6 O9 -","- C34 H40 B Ir N6 O9 -","- C68 H80 B2 Ir2 N12 O18 -","2","1","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.0465","0.0362","","","0.0851","0.0988","","","","","","1.113","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078043","19.208","0.0009","20.8774","0.001","22.3156","0.0011","90","","115.476","0.001","90","","8078.7","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H45 B Ir N6 O6.5 -","- C37 H45 B Ir N6 O6.5 -","- C296 H360 B8 Ir8 N48 O52 -","8","2","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.0691","0.0508","","","0.1301","0.139","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078044","10.0506","0.0012","18.31","0.002","22.032","0.003","90","","100.479","0.003","90","","3986.8","0.8","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H42 B Ir N6 O10 -","- C35 H42 B Ir N6 O10 -","- C140 H168 B4 Ir4 N24 O40 -","4","1","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.0975","0.0513","","","0.1142","0.1411","","","","","","1.045","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078045","10.4342","0.0007","18.6223","0.0012","18.3236","0.0012","90","","105.63","0.0008","90","","3428.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H39 B Ir N7 O9 -","- C33 H39 B Ir N7 O9 -","- C132 H156 B4 Ir4 N28 O36 -","4","1","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.0359","0.026","","","0.0581","0.0625","","","","","","1.032","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078046","13.507","0.003","20.843","0.004","19.049","0.004","90","","103.087","0.005","90","","5223.5","1.9","295","2","295","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H55 B Cl4 Ir N7 O13 -","- C44 H55 B Cl4 Ir N7 O13 -","- C176 H220 B4 Cl16 Ir4 N28 O52 -","4","1","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.0482","0.0288","","","0.0654","0.0694","","","","","","0.953","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078047","40.649","0.005","11.7275","0.0014","17.87","0.002","90","","105.232","0.002","90","","8219.6","1.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H45 B Ir N7 O13 -","- C38 H45 B Ir N7 O13 -","- C304 H360 B8 Ir8 N56 O104 -","8","1","","Roa, Arián E.; Salazar, Verónica; López-Serrano, Joaqu\?ín; Oñate, Enrique; Alvarado-Rodr\?íguez, José G.; Paneque, Margarita; Poveda, Manuel L.","Coupling of Aromatic Aldehydes with CO2Me-Substituted TpMe2Ir(III) Metallacyclopentadienes","Organometallics","2012","31","8","3185","","10.1021/om3000554","","","0.71073","MoKα","","0.042","0.0277","","","0.0605","0.0663","","","","","","1.008","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078048","28.017","0.0006","8.761","0.0003","19.836","0.0006","90","","127.287","0.0012","90","","3873.7","0.2","230","0.1","230","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H50 Cl2 N4 O2 Si4 Ti -","- C28 H50 Cl2 N4 O2 Si4 Ti -","- C112 H200 Cl8 N16 O8 Si16 Ti4 -","4","0.5","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.056","0.036","","","0.0969","0.1016","","","","","","0.942","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078049","28.489","0.0005","8.804","0.0003","20.185","0.0005","90","","128.743","0.0014","90","","3948.7","0.2","230","0.1","230","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H54 Cl2 N4 Si4 Ti -","- C30 H54 Cl2 N4 Si4 Ti -","- C120 H216 Cl8 N16 Si16 Ti4 -","4","0.5","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.0488","0.0325","","","0.0849","0.0884","","","","","","0.95","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078050","19.879","0.004","8.79","0.002","24.641","0.005","90","","92.1","0.02","90","","4302.8","1.6","230","2","230","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Moris-75 (Sinay)","","","- C34 H62 Cl2 N4 Si4 Ti -","- C34 H62 Cl2 N4 Si4 Ti -","- C136 H248 Cl8 N16 Si16 Ti4 -","4","0.5","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.0931","0.0426","","","0.0886","0.1002","","","","","","0.948","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078051","29.275","0.006","8.743","0.002","20.41","0.004","90","","130.78","0.03","90","","3956","2","240","2","240","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Moris-231(Peng)","","","- C14 H22 Cl F3 N2 Si2 Ti0.5 -","- C14 H22 Cl F3 N2 Si2 Ti0.5 -","- C112 H176 Cl8 F24 N16 Si16 Ti4 -","8","1","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.1367","0.0604","","","0.1323","0.1529","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078052","12.668","0.002","14.129","0.003","14.997","0.003","67.68","0.02","74.05","0.02","65.47","0.02","2237","0.9","230","1","230","0.1","","","","","","","","6","P -1","-P 1","2","titbutdim","","","- C34 H62 Cl2 N4 Si4 Ti -","- C34 H62 Cl2 N4 Si4 Ti -","- C68 H124 Cl4 N8 Si8 Ti2 -","2","1","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.0742","0.0402","","","0.1132","0.1247","","","","","","0.962","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078053","11.756","0.002","19.61","0.004","17.732","0.004","90","","107.44","0.03","90","","3899.9","1.5","230","2","230","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","tiometdim","","","- C28 H50 Cl2 N4 O2 Si4 Ti -","- C28.8 H50 Cl2 N4 O2 Si4 Ti -","- C115.2 H200 Cl8 N16 O8 Si16 Ti4 -","4","1","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.0825","0.0439","","","0.1181","0.1255","","","","","","0.883","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078054","20.849","0.004","8.695","0.002","21.729","0.004","90","","97.45","0.03","90","","3905.8","1.4","230","2","230","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","tioeth","","","- C30 H54 Cl2 N4 Si4 Ti -","- C30 H54 Cl2 N4 Si4 Ti -","- C120 H216 Cl8 N16 Si16 Ti4 -","4","0.5","","Aharonovich, Sinai; Botoshansky, Mark; Balazs, Yael S.; Eisen, Moris S.","Elucidation of Substituent Effects in the Polymerization of Propylene Promoted by Titanium Amidinates","Organometallics","2012","31","8","3435","","10.1021/om300068w","","","0.71073","MoKα","","0.083","0.0362","","","0.0832","0.0888","","","","","","0.814","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078055","8.5322","0.0001","13.8453","0.0004","20.3891","0.0005","90","","90","","90","","2408.58","0.1","150","1","150","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 Cl F6 Ir N3 P -","- C21 H28 Cl F6 Ir N3 P -","- C84 H112 Cl4 F24 Ir4 N12 P4 -","4","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Bifunctional Mechanism with Unconventional Intermediates for the Hydrogenation of Ketones Catalyzed by an Iridium(III) Complex Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2152","","10.1021/om300071v","","","0.71073","MoKα","","0.039","0.0322","","","0.0656","0.068","","","","","","1.123","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078056","10.3727","0.0003","15.5571","0.0008","17.9983","0.0007","90","","90.939","0.003","90","","2904","0.2","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H33 Cl F6 Ir N P2 -","- C29 H33 Cl F6 Ir N P2 -","- C116 H132 Cl4 F24 Ir4 N4 P8 -","4","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Bifunctional Mechanism with Unconventional Intermediates for the Hydrogenation of Ketones Catalyzed by an Iridium(III) Complex Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2152","","10.1021/om300071v","","","0.71073","MoKα","","0.0981","0.06","","","0.1431","0.162","","","","","","1.022","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078057","8.7118","0.0006","12.5177","0.0009","14.8188","0.001","95.229","0.003","105.119","0.003","103.237","0.003","1498.93","0.18","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C21 H29 F6 Ir N3 P -","- C21 H29 F6 Ir N3 P -","- C42 H58 F12 Ir2 N6 P2 -","2","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Bifunctional Mechanism with Unconventional Intermediates for the Hydrogenation of Ketones Catalyzed by an Iridium(III) Complex Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2152","","10.1021/om300071v","","","0.71073","MoKα","","0.0428","0.0365","","","0.095","0.0976","","","","","","1.062","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078058","7.9384","0.0002","17.4723","0.0005","17.3362","0.0004","90","","100.446","0.0015","90","","2364.71","0.11","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 Cl F6 Ir N3 P -","- C19 H32 Cl F6 Ir N3 P -","- C76 H128 Cl4 F24 Ir4 N12 P4 -","4","1","","O, Wylie W. N.; Lough, Alan J.; Morris, Robert H.","Bifunctional Mechanism with Unconventional Intermediates for the Hydrogenation of Ketones Catalyzed by an Iridium(III) Complex Containing an N-Heterocyclic Carbene with a Primary Amine Donor","Organometallics","2012","31","6","2152","","10.1021/om300071v","","","0.71073","MoKα","","0.0479","0.0359","","","0.0858","0.0926","","","","","","1.074","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078059","9.8973","0.0009","7.4957","0.0004","21.1","0.002","90","","93.407","0.007","90","","1562.6","0.2","173","2","173","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C17 H20 N4 O2 -","- C17 H20 N4 O2 -","- C68 H80 N16 O8 -","4","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.0787","0.0449","","","0.093","0.1026","","","","","","0.904","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078060","34.6611","0.0004","34.6611","0.0004","22.335","0.0003","90","","90","","90","","26833.1","0.6","193","2","193","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C30 H43 N6 O6.5 -","- C30 H43 N6 O6.5 -","- C960 H1376 N192 O208 -","32","2","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","1.54178","CuKα","","0.1308","0.1109","","","0.3432","0.3694","","","","","","1.533","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078061","9.1607","0.0004","14.1667","0.0008","9.6108","0.0004","90","","114.902","0.003","90","","1131.3","0.1","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C19 H26 Cl2 N4 O3 Pd -","- C19 H26 Cl2 N4 O3 Pd -","- C38 H52 Cl4 N8 O6 Pd2 -","2","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.0332","0.033","","","0.0843","0.0845","","","","","","1.022","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078062","19.6707","0.0019","12.5604","0.0015","11.856","0.003","90","","94.787","0.013","90","","2919.1","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H40 N4 O2 Ru -","- C31 H40 N4 O2 Ru -","- C124 H160 N16 O8 Ru4 -","4","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.201","0.0737","","","0.1248","0.1716","","","","","","0.747","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078063","14.2553","0.0006","17.3216","0.0007","17.9782","0.0008","101.431","0.004","102.004","0.003","91.638","0.003","4244.8","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C87 H83 Ir2 N15 O4 Tl2 -","- C87 H83 Ir2 N15 O4 Tl2 -","- C174 H166 Ir4 N30 O8 Tl4 -","2","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.0976","0.0531","","","0.1156","0.1255","","","","","","0.754","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078064","8.7625","0.0006","12.9304","0.001","17.2848","0.0013","90.59","0.006","101.634","0.006","95.57","0.006","1908.2","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H57 Ir N4 O5 -","- C39 H57 Ir N4 O5 -","- C78 H114 Ir2 N8 O10 -","2","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.076","0.0527","","","0.1116","0.1179","","","","","","0.926","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078065","10.4679","0.0003","21.7161","0.0011","26.6018","0.001","90","","90","","90","","6047.2","0.4","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C31 H41 Ir N4 O2 -","- C31 H41 Ir N4 O2 -","- C248 H328 Ir8 N32 O16 -","8","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.0471","0.0339","","","0.0805","0.0857","","","","","","1.015","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078066","21.5132","0.0008","14.3154","0.0003","22.558","0.0008","90","","102.434","0.003","90","","6784.2","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C31 H42 Cl2 Ir N4 O3.5 Pd -","- C31 H42 Cl2 Ir N4 O3.5 Pd -","- C248 H336 Cl16 Ir8 N32 O28 Pd8 -","8","1","","Blasberg, Florian; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Mononuclear (O,O′ orN,N′) and Heterodinuclear (O,O′ andN,N′) Transition-Metal Complexes ofortho-Quinoid Bis(pyrazol-1-yl)methane Ligands","Organometallics","2012","31","8","3213","","10.1021/om3000746","","","0.71073","MoKα","","0.0452","0.0344","","","0.0722","0.0753","","","","","","1.024","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078067","19.6169","0.0014","11.047","0.0008","16.2607","0.0011","90","","112.487","0.003","90","","3255.9","0.4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H28 B F10 Li O2 S -","- C35 H28 B F10 Li O2 S -","- C140 H112 B4 F40 Li4 O8 S4 -","4","0.5","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.102","0.089","","","0.1585","0.1646","","","","","","1.144","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078068","41.347","0.004","41.347","0.004","13.4355","0.0019","90","","90","","90","","22969","5","150","2","150","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C64 H43 B F10 O0.25 P2 Ru S -","- C64 H43 B F10 O0.25 P2 Ru S -","- C1024 H688 B16 F160 O4 P32 Ru16 S16 -","16","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.0716","0.0497","","","0.1085","0.117","","","","","","1.089","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078069","15.7292","0.0016","17.8914","0.0015","19.3892","0.0019","90","","95.229","0.003","90","","5433.8","0.9","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C63 H46 B F10 P2 Ru S -","- C63 H46 B F10 P2 Ru S -","- C252 H184 B4 F40 P8 Ru4 S4 -","4","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.1142","0.0519","","","0.099","0.1213","","","","","","0.978","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078070","11.3327","0.0004","21.2938","0.0007","25.871","0.001","90","","98.809","0.001","90","","6169.5","0.4","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C71 H57 B F10 O0 P2 Rh S -","- C71 H57 B F10 P2 Rh S -","- C284 H228 B4 F40 P8 Rh4 S4 -","4","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.0751","0.0438","","","0.0967","0.1082","","","","","","1.013","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078071","8.6116","0.0004","18.3794","0.0011","19.3884","0.0012","90","","91.026","0.002","90","","3068.2","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H24 B F10 Rh S -","- C35 H24 B F10 Rh S -","- C140 H96 B4 F40 Rh4 S4 -","4","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.0513","0.0301","","","0.0571","0.0626","","","","","","1.018","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078072","12.0518","0.0005","25.9871","0.0009","19.0097","0.0007","90","","90.876","0.001","90","","5953","0.4","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C69 H58 B F10 P2 Rh S -","- C69 H44 B F10 P2 Rh S -","- C276 H176 B4 F40 P8 Rh4 S4 -","4","1","","Dahcheh, Fatme; Stephan, Douglas W.","Ruthenium and Rhodium Complexes of Thioether-Alkynylborates","Organometallics","2012","31","8","3222","","10.1021/om300075r","","","0.71073","MoKα","","0.0348","0.029","","","0.0727","0.0764","","","","","","1.067","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078073","9.3588","0.0004","10.8077","0.0005","10.4727","0.0005","90","","94.896","0.002","90","","1055.42","0.08","100","2","100","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C21 H36 N2 O -","- C21 H36 N2 O -","- C42 H72 N4 O2 -","2","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.0332","0.0316","","","0.0812","0.0824","","","","","","1.07","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078074","11.1435","0.0006","18.595","0.0011","13.8363","0.0009","90","","110.484","0.003","90","","2685.8","0.3","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H43 N3 O2 -","- C27 H43 N3 O2 -","- C108 H172 N12 O8 -","4","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.0763","0.0523","","","0.1276","0.1491","","","","","","1.038","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078075","13.4011","0.0004","17.9193","0.0006","20.5171","0.0007","90","","98.656","0.001","90","","4870.8","0.3","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C49 H76 N4 O2 Zr -","- C49 H76 N4 O2 Zr -","- C196 H304 N16 O8 Zr4 -","4","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.066","0.0577","","","0.1169","0.12","","","","","","1.243","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078076","12.963","0.0003","13.2343","0.0004","17.9935","0.0005","72.56","0.001","86.767","0.001","76.777","0.001","2866.67","0.14","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C66 H82 N2 O Zr -","- C66 H82 N2 O Zr -","- C132 H164 N4 O2 Zr2 -","2","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.0436","0.0321","","","0.0804","0.086","","","","","","1.029","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078077","14.3383","0.0004","16.4928","0.0004","17.3099","0.0004","90","","90","","90","","4093.42","0.18","100","2","100","2","","","","","","","synthesis as described","5","P c a 21","P 2c -2ac","29","","","","- C38 H65 Hf N7 O -","- C38 H65 Hf N7 O -","- C152 H260 Hf4 N28 O4 -","4","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.0208","0.0174","","","0.0399","0.0414","","","","","","0.969","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078078","15.531","0.004","18.501","0.004","18.531","0.006","59.979","0.01","66.87","0.009","79.767","0.007","4239","2","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C63 H102 Cl4 N6 O4 Zr3 -","- C63 H102 Cl4 N6 O4 Zr3 -","- C126 H204 Cl8 N12 O8 Zr6 -","2","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.1083","0.089","","","0.2462","0.2581","","","","","","1.091","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078079","32.642","0.002","18.8242","0.0011","45.503","0.003","90","","100.933","0.004","90","","27452","3","100","2","100","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C117 H164 Cl6 N6 O4 Zr3 -","- C117 H164 Cl6 N6 O4 Zr3 -","- C936 H1312 Cl48 N48 O32 Zr24 -","8","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.2309","0.1174","","","0.2801","0.3206","","","","","","0.936","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078080","16.165","0.0007","19.8104","0.001","27.4099","0.0012","90","","90","","90","","8777.6","0.7","100","2","100","2","","","","","","","synthesis as described","6","I 2 c b","I -2a 2","45","","","","- C43 H63 Cl3 N2 O2 Zr -","- C43 H63 Cl3 N2 O2 Zr -","- C344 H504 Cl24 N16 O16 Zr8 -","8","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.1399","0.1289","","","0.1998","0.2036","","","","","","1.363","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078081","11.5077","0.0012","20.826","0.002","28.044","0.003","106.883","0.005","101.979","0.005","92.952","0.005","6246.3","1.1","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C126 H182 Cl4 N8 O4 Zr2 -","- C126 H182 Cl4 N8 O4 Zr2 -","- C252 H364 Cl8 N16 O8 Zr4 -","2","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.1056","0.0765","","","0.1849","0.2078","","","","","","1.153","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078082","51.616","0.004","13.557","0.001","25.9087","0.0019","90","","115.909","0.003","90","","16308","2","150","2","150","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C78 H110 Cl2 N4 O2 Zr -","- C78 H110 Cl2 N4 O2 Zr -","- C624 H880 Cl16 N32 O16 Zr8 -","8","1","","Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Synthesis and Structural Diversity of Group 4 Metal Complexes with Multidentate Tethered Phenoxy-Amidine and Phenoxy-Amidinate Ligands","Organometallics","2012","31","8","3228","","10.1021/om300076j","","x-ray","0.71073","MoKα","","0.1239","0.1058","","","0.2935","0.304","","","","","","1.065","","","","has coordinates,has disorder","178669","2020-10-21","18:00:00",""
"4078083","18.436","0.013","9.448","0.007","21.777","0.015","90","","90","","90","","3793","5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H26 N2 O -","- C22 H26 N2 O -","- C176 H208 N16 O8 -","8","1","","Hu, Ping; Qiao, Ya-Lin; Wang, Jian-Qiang; Jin, Guo-Xin","Syntheses, Characterization, and Ethylene Polymerization of Titanium Complexes with Double-Duty Tridentate [ONN] Ligands","Organometallics","2012","31","8","3241","","10.1021/om300091e","","","0.71073","MoKα","","0.1255","0.0592","","","0.1448","0.1899","","","","","","0.964","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4078084","10.188","0.003","17.884","0.005","13.481","0.004","90","","110.721","0.004","90","","2297.4","1.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H23 Cl3 N2 O Ti -","- C22 H23 Cl3 N2 O Ti -","- C88 H92 Cl12 N8 O4 Ti4 -","4","1","","Hu, Ping; Qiao, Ya-Lin; Wang, Jian-Qiang; Jin, Guo-Xin","Syntheses, Characterization, and Ethylene Polymerization of Titanium Complexes with Double-Duty Tridentate [ONN] Ligands","Organometallics","2012","31","8","3241","","10.1021/om300091e","","","0.71073","MoKα","","0.0816","0.0491","","","0.1101","0.1203","","","","","","0.888","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078085","9.016","0.004","11.529","0.006","16.364","0.008","89.636","0.013","75.48","0.012","88.43","0.012","1646","1.4","163","2","163","2","","","","","","","","5","P -1","-P 1","2","GuanidinateBisTMSamide Zr","Guanidinate BisTMSamide Zr","","- C25 H58 N6 Si2 Zr -","- C25 H58 N6 Si2 Zr -","- C50 H116 N12 Si4 Zr2 -","2","1","","Chen, Shu-Jian; Dougan, Brenda A.; Chen, Xue-Tai; Xue, Zi-Ling","Preparation of Zirconium Guanidinate Complexes from the Direct Insertion of a Carbodiimine and Aminolysis Using a Guanidine. Comparison of the Reactions","Organometallics","2012","31","8","3443","","10.1021/om300097a","","","0.71073","MoKα","","0.0375","0.0356","","","0.0965","0.0984","","","","","","1.035","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078086","9.635","0.007","11.677","0.009","17.915","0.013","96.198","0.015","95.664","0.017","93.531","0.016","1989","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","Guanidinate TriTMSsilyl Zr","Guanidinate TriTMSsilyl Zr","","- C28 H67 N5 Si4 Zr -","- C28 H67 N5 Si4 Zr -","- C56 H134 N10 Si8 Zr2 -","2","1","","Chen, Shu-Jian; Dougan, Brenda A.; Chen, Xue-Tai; Xue, Zi-Ling","Preparation of Zirconium Guanidinate Complexes from the Direct Insertion of a Carbodiimine and Aminolysis Using a Guanidine. Comparison of the Reactions","Organometallics","2012","31","8","3443","","10.1021/om300097a","","","0.71073","MoKα","","0.0312","0.0293","","","0.0952","0.0979","","","","","","1.139","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078087","9.6674","0.0011","16.4856","0.0019","21.5869","0.0019","90","","114.389","0.004","90","","3133.4","0.6","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Amine","Amine","","- C15 H29 N3 -","- C15 H29 N3 -","- C120 H232 N24 -","8","2","","Chen, Shu-Jian; Dougan, Brenda A.; Chen, Xue-Tai; Xue, Zi-Ling","Preparation of Zirconium Guanidinate Complexes from the Direct Insertion of a Carbodiimine and Aminolysis Using a Guanidine. Comparison of the Reactions","Organometallics","2012","31","8","3443","","10.1021/om300097a","","","0.71073","MoKα","","0.0415","0.0365","","","0.0892","0.092","","","","","","1.051","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078088","15.3608","0.0005","16.6451","0.0006","18.19","0.001","103.746","0.002","104.557","0.002","111.57","0.002","3894.8","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C69.5 H77.5 Fe6 O Si4 -","- C69.5 H77.5 Fe6 O Si4 -","- C139 H155 Fe12 O2 Si8 -","2","1","","Bruña, Sonia; Nieto, Daniel; González-Vadillo, Ana M; Perles, Josefina; Cuadrado, Isabel","Cubic Octasilsesquioxanes, Cyclotetrasiloxanes, and Disiloxanes Maximally Functionalized with Silicon-Bridged Interacting Triferrocenyl Units","Organometallics","2012","31","8","3248","","10.1021/om300101w","","","0.71073","MoKα","","0.1685","0.1152","","","0.3535","0.4033","","","","","","1.574","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078089","12.5503","0.0014","15.5866","0.0017","16.136","0.0005","73.48","0.02","68.232","0.017","82.6","0.03","2809.4","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C75 H62 N2 -","- C75 H62 N2 -","- C150 H124 N4 -","2","1","","Balogh, János; Slawin, Alexandra M. Z.; Nolan, Steven P.","BulkyN-Heterocyclic Carbene IPr* in Selected Organo- and Transition Metal-Mediated Catalytic Applications","Organometallics","2012","31","8","3259","","10.1021/om300104j","","","1.54178","CuKα","","0.1272","0.0892","","","0.2494","0.327","","","","","","1.221","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078090","11.917","0.004","18.587","0.006","24.747","0.008","90","","95.972","0.005","90","","5452","3","366","2","366","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H56 N2 Ni O3 -","- C72 H56 N2 Ni O3 -","- C288 H224 N8 Ni4 O12 -","4","1","","Balogh, János; Slawin, Alexandra M. Z.; Nolan, Steven P.","BulkyN-Heterocyclic Carbene IPr* in Selected Organo- and Transition Metal-Mediated Catalytic Applications","Organometallics","2012","31","8","3259","","10.1021/om300104j","","","0.71073","MoKα","","0.0758","0.0637","","","0.1834","0.1991","","","","","","0.777","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078091","15.238","0.003","25.562","0.005","18.197","0.004","90","","91.91","0.003","90","","7084","3","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C88 H80 Cl N2 Ru -","- C88 H80 Cl N2 Ru -","- C352 H320 Cl4 N8 Ru4 -","4","1","","Balogh, János; Slawin, Alexandra M. Z.; Nolan, Steven P.","BulkyN-Heterocyclic Carbene IPr* in Selected Organo- and Transition Metal-Mediated Catalytic Applications","Organometallics","2012","31","8","3259","","10.1021/om300104j","","","0.71073","MoKα","","0.1244","0.0897","","","0.2266","0.2364","","","","","","1.159","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078092","9.7324","0.0019","10.672","0.002","19.838","0.005","79.379","0.015","79.588","0.017","70.281","0.015","1890.7","0.7","98","2","98","2","","","","","","","","5","P -1","-P 1","2","","<b>[FeCl~2~(IMes)~2~]</b> ?","","- C42 H48 Cl2 Fe N4 -","- C42 H48 Cl2 Fe N4 -","- C84 H96 Cl4 Fe2 N8 -","2","1","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0668","0.0524","","","0.1036","0.1128","","","","","","0.995","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078093","11.3358","0.0012","17.994","0.002","11.2776","0.0013","90","","115.592","0.008","90","","2074.7","0.4","98","2","98","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<b>[Fe~2~Cl~2~(μ-Cl)~2~(IMes)~2~]</b> ?","","- C42 H48 Cl4 Fe2 N4 -","- C42 H48 Cl4 Fe2 N4 -","- C84 H96 Cl8 Fe4 N8 -","2","0.5","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.083","0.0601","","","0.1239","0.1327","","","","","","1.099","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078094","12.389","0.003","14.02","0.004","16.487","0.005","90","","93.757","0.005","90","","2857.5","1.4","98","2","98","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<b>[Fe~2~Cl~2~(μ-Cl)~2~(IPr)~2~]</b> ?","","- C54 H72 Cl4 Fe2 N4 -","- C54 H72 Cl4 Fe2 N4 -","- C108 H144 Cl8 Fe4 N8 -","2","0.5","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0461","0.0414","","","0.0906","0.0934","","","","","","1.003","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078095","10.672","0.0018","12.236","0.0016","16.135","0.003","70.865","0.008","88.637","0.011","66.44","0.009","1810.6","0.5","98","2","98","2","","","","","","","","5","P -1","-P 1","2","","<b>[Fe~2~Br~2~(μ-Br)~2~(IPr)~2~]</b> ?","","- C78 H96 Br4 Fe2 N4 -","- C78 H96 Br4 Fe2 N4 -","- C78 H96 Br4 Fe2 N4 -","1","0.5","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0355","0.0324","","","0.0719","0.0735","","","","","","1","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078096","11.0066","0.001","17.7366","0.0019","16.2355","0.0016","90","","94.919","0.007","90","","3157.8","0.5","98","2","98","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","<b>[Fe~2~Cl~2~(μ-Cl)~2~(IPr^Cl^)~2~]</b> ?","","- C60 H74 Cl8 Fe2 N4 -","- C60 H74 Cl8 Fe2 N4 -","- C120 H148 Cl16 Fe4 N8 -","2","0.5","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0339","0.0282","","","0.0698","0.0726","","","","","","1.001","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078097","18.212","0.003","16.237","0.003","20.136","0.003","90","","102.909","0.003","90","","5803.9","1.7","98","2","98","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<b>[FeCl~3~(IPr)]</b> ?","","- C27 H36 Cl3 Fe N2 -","- C27 H36 Cl3 Fe N2 -","- C216 H288 Cl24 Fe8 N16 -","8","2","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0637","0.0517","","","0.1244","0.1334","","","","","","1.016","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078098","19.676","0.004","8.9433","0.0016","16.847","0.004","90","","95.156","0.007","90","","2952.5","1.1","98","2","98","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","<b>[FeCl~3~(IPr^Cl^)]</b> ?","","- C27 H34 Cl5 Fe N2 -","- C27 H34 Cl5 Fe N2 -","- C108 H136 Cl20 Fe4 N8 -","4","1","","Przyojski, Jacob A.; Arman, Hadi D.; Tonzetich, Zachary J.","Complexes of Iron(II) and Iron(III) Containing Aryl-Substituted N-Heterocyclic Carbene Ligands","Organometallics","2012","31","8","3264","","10.1021/om300106u","","","0.71073","MoKα","","0.0427","0.0366","","","0.0903","0.094","","","","","","1.002","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078099","10.6221","0.0003","22.8457","0.0007","20.399","0.0005","90","","103.046","0.001","90","","4822.4","0.2","193","2","193","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C41 H36 Cl5 F6 Fe2 N2 O4 P3 S2 -","- C41 H36 Cl5 F6 Fe2 N2 O4 P3 S2 -","- C164 H144 Cl20 F24 Fe8 N8 O16 P12 S8 -","4","1","","Olsen, Matthew T.; Rauchfuss, Thomas B.; Zaffaroni, Riccardo","Reaction of Aryl Diazonium Salts and Diiron(I) Dithiolato Carbonyls: Evidence for Radical Intermediates.","Organometallics","2012","31","8","3447","3450","10.1021/om300107s","","","0.71073","MoKα","","0.0666","0.0394","","","0.08","0.0907","","","","","","1.008","","","","has coordinates","178669","2020-10-21","18:00:00",""
"4078100","9.3869","0.0001","16.6437","0.0004","15.1145","0.0003","90","","90","","90","","2361.38","0.08","223","2","223","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C20 H42 Al N Si -","- C20 H42 Al N Si -","- C80 H168 Al4 N4 Si4 -","4","0.5","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","0.71073","MoKα","","0.0719","0.0561","","","0.1246","0.1358","","","","","","1.038","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078101","14.8891","0.0005","18.0127","0.0005","9.6036","0.0003","90","","90","","90","","2575.62","0.14","223","2","223","2","","","","","","","","5","A m a 2","A 2 -2a","40","","","","- C22 H46 Al N Si -","- C22 H46 Al N Si -","- C88 H184 Al4 N4 Si4 -","4","0.5","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","0.71073","MoKα","","0.0616","0.0543","","","0.1285","0.1371","","","","","","1.068","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078102","10.2729","0.0002","10.5164","0.0002","10.9519","0.0002","89.542","0.001","77.895","0.001","80.942","0.001","1142.06","0.04","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H42 Al N Si -","- C20 H42 Al N Si -","- C40 H84 Al2 N2 Si2 -","2","1","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","0.71073","MoKα","","0.0565","0.0491","","","0.1158","0.1229","","","","","","1.058","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078103","9.4759","0.0002","11.2988","0.0002","11.4975","0.0003","70.926","0.001","75.311","0.001","79.469","0.001","1118.65","0.04","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H39 Al N2 Si -","- C18 H39 Al N2 Si -","- C36 H78 Al2 N4 Si2 -","2","1","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","0.71073","MoKα","","0.064","0.0565","","","0.1437","0.1535","","","","","","1.081","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078104","9.8157","0.0001","17.2096","0.0002","17.4767","0.0002","90","","96.555","0.001","90","","2932.94","0.06","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H48 Al N Si -","- C28 H48 Al N Si -","- C112 H192 Al4 N4 Si4 -","4","1","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","1.54184","CuKα","","0.0476","0.0419","","","0.1144","0.1191","","","","","","1.055","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078105","10.8618","0.0002","16.7278","0.0003","19.8032","0.0003","90","","98.799","0.001","90","","3555.78","0.11","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H64 Al N3 Si -","- C33 H64 Al N3 Si -","- C132 H256 Al4 N12 Si4 -","4","1","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","1.54184","CuKα","","0.0516","0.044","","","0.1161","0.1221","","","","","","1.036","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078106","10.9837","0.0002","16.3149","0.0003","20.0517","0.0004","90","","102.296","0.001","90","","3510.8","0.12","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H61 Al N4 Si -","- C31 H61 Al N4 Si -","- C124 H244 Al4 N16 Si4 -","4","1","","Holtrichter-Rößmann, Thorsten; Rösener, Christian; Hellmann, Johannes; Uhl, Werner; Würthwein, Ernst-Ulrich; Fröhlich, Roland; Wibbeling, Birgit","Generation of Weakly Bound Al‒N Lewis Pairs by Hydroalumination of Ynamines and the Activation of Small Molecules: Phenylethyne and Dicyclohexylcarbodiimide","Organometallics","2012","31","8","3272","","10.1021/om3001179","","","1.54184","CuKα","","0.0535","0.0478","","","0.1322","0.1382","","","","","","1.034","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078107","16.5909","0.0006","8.5787","0.0004","18.0461","0.0007","90","","108.652","0.0012","90","","2433.57","0.17","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H37 Cl2 P Ru2 S -","- C22 H37 Cl2 P Ru2 S -","- C88 H148 Cl8 P4 Ru8 S4 -","4","0.5","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.0175","","","","0.0444","","","","","","1","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078108","13.9721","0.0008","17.8282","0.0013","22.6549","0.0013","90","","97.032","0.0016","90","","5600.8","0.6","173","","173","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C52 H88 Cl2 O2 P2 Ru4 S2 -","- C50 H72 Cl2 O3.5 P2 Ru4 S2 -","- C200 H288 Cl8 O14 P8 Ru16 S8 -","4","0.5","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.0494","","","","0.1522","","","","","","1","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078109","20.4886","0.0012","8.3947","0.0006","22.4029","0.0013","90","","113.415","0.0014","90","","3535.9","0.4","173","","173","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H54 Cl N2 P Ru2 S -","- C32 H54 Cl N2 P Ru2 S -","- C128 H216 Cl4 N8 P4 Ru8 S4 -","4","1","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.0682","","","","0.2134","","","","","","1","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078110","8.629","0.002","10.694","0.003","14.922","0.003","80.105","0.005","87.814","0.006","89.707","0.007","1355.5","0.6","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H36 F6 P2 Ru2 S -","- C22 H36 F6 P2 Ru2 S -","- C44 H72 F12 P4 Ru4 S2 -","2","1","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.1079","","","","0.2342","","","","","","1","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078111","13.4501","0.0005","14.05","0.0005","19.3656","0.0006","90","","108.944","0.0008","90","","3461.4","0.2","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H46 Cl3 P Ru2 S -","- C32 H46 Cl3 P Ru2 S -","- C128 H184 Cl12 P4 Ru8 S4 -","4","1","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.0394","","","","0.0705","","","","","","1","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078112","14.037","0.0007","19.5485","0.0009","11.3344","0.0005","90","","90","","90","","3110.2","0.3","173","","173","","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C31 H44 Cl O P Ru2 S -","- C31 H44 Cl O P Ru2 S -","- C124 H176 Cl4 O4 P4 Ru8 S4 -","4","1","","Miyake, Yoshihiro; Moriyama, Taichi; Tanabe, Yoshiaki; Endo, Satoshi; Nishibayashi, Yoshiaki","Synthesis and Reactivity of Hybrid Phosphido- and Hydrosulfido-Bridged Diruthenium Complexes: Transformations into Diruthenium and Tetraruthenium Complexes Bridged by Phosphido and Sulfido Ligands","Organometallics","2012","31","8","3292","","10.1021/om3001247","","","0.71075","MoKα","","","0.065","","","","0.1089","","","","","","1","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078113","29.188","0.008","10.387","0.003","9.599","0.003","90","","90","","90","","2910.2","1.5","296","2","296","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C31 H16 O9 W3 -","- C31 H16 O9 W3 -","- C124 H64 O36 W12 -","4","1","","Lynch, Thomas J.; Carroll, James M.; Helvenston, Merritt C.; Tisch, Theodore L.; Rheingold, Arnold L.; Staley, Donna L.; Mahmoudkhani, Amir","Trindenyl Trimolybdenum and Tritungsten Complexes: Crystal Structure of (trindenyl)[(OC)3W‒W(CO)3]W(CO)3Bn","Organometallics","2012","31","8","3300","","10.1021/om3001263","","","0.71073","MoKα","","0.0393","0.0393","","","0.1132","0.1132","","","","","","0.742","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078114","12.779","0.0005","13.5488","0.0004","14.6215","0.0006","77.687","0.002","82.317","0.002","89.368","0.002","2450.73","0.16","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C25 H38 P2 -","- C25 H38 P2 -","- C100 H152 P8 -","4","2","","Burford, Richard J.; Piers, Warren E.; Parvez, Masood","β-Elimination-Immune PCcarbeneP Iridium Complexes via Double C–H Activation: Ligand–Metal Cooperation in Hydrogen Activation","Organometallics","2012","31","8","2949","","10.1021/om300127g","","","0.71073","MoKα","","0.121","0.0731","","","0.1224","0.1464","","","","","","1.138","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078115","11.683","0.0003","13.7788","0.0006","16.6934","0.0006","90","","105.398","0.002","90","","2590.81","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H36 Br0.3 Cl0.7 Ir P2 -","- C25 H36 Br0.3 Cl0.7 Ir P2 -","- C100 H144 Br1.2 Cl2.8 Ir4 P8 -","4","1","","Burford, Richard J.; Piers, Warren E.; Parvez, Masood","β-Elimination-Immune PCcarbeneP Iridium Complexes via Double C‒H Activation: Ligand‒Metal Cooperation in Hydrogen Activation","Organometallics","2012","31","8","2949","","10.1021/om300127g","","","0.71073","MoKα","","0.0616","0.0459","","","0.0901","0.1009","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078116","10.1632","0.0004","11.1101","0.0005","15.4725","0.0007","97.4904","0.0012","92.3654","0.0016","115.573","0.0014","1553.14","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H47 Ir P2 -","- C34 H47 Ir P2 -","- C68 H94 Ir2 P4 -","2","1","","Burford, Richard J.; Piers, Warren E.; Parvez, Masood","β-Elimination-Immune PCcarbeneP Iridium Complexes via Double C‒H Activation: Ligand‒Metal Cooperation in Hydrogen Activation","Organometallics","2012","31","8","2949","","10.1021/om300127g","","","0.71073","MoKα","","0.037","0.0329","","","0.0773","0.0798","","","","","","1.06","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078117","7.8518","0.0008","11.198","0.0012","15.7007","0.0016","90","","90.659","0.002","90","","1380.4","0.2","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C9 H18 B10 -","- C9 H18 B10 -","- C36 H72 B40 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0596","0.0493","","","0.1294","0.1401","","","","","","1.038","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078118","9.776","0.002","12.704","0.003","21.986","0.005","90","","90","","90","","2730.5","1.1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C9 H18 B10 -","- C9 H18 B10 -","- C72 H144 B80 -","8","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0902","0.0636","","","0.1623","0.191","","","","","","1.039","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078119","13.7034","0.0007","11.7088","0.0006","10.3673","0.0005","90","","90","","90","","1663.44","0.14","296","2","296","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C12 H24 B10 -","- C12 H25 B10 -","- C48 H100 B40 -","4","0.5","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0645","0.0561","","","0.1605","0.1763","","","","","","1.081","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078120","13.8031","0.0007","14.163","0.0008","18.1401","0.0009","90","","90","","90","","3546.3","0.3","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H24 B10 Si -","- C11 H24 B10 Si -","- C88 H192 B80 Si8 -","8","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0543","0.0417","","","0.1168","0.1341","","","","","","1.056","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078121","8.7491","0.0007","11.0052","0.0009","18.6504","0.0015","90","","90","","90","","1795.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 B10 -","- C16 H20 B10 -","- C64 H80 B40 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.1002","0.0555","","","0.1093","0.1287","","","","","","0.921","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078122","10.9237","0.0013","12.9995","0.0016","13.1941","0.0017","90","","108.921","0.002","90","","1772.4","0.4","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 B10 -","- C16 H20 B10 -","- C64 H80 B40 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0451","0.0408","","","0.1156","0.1209","","","","","","0.992","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078123","16.2191","0.0011","9.6468","0.0006","14.5023","0.001","90","","105.859","0.001","90","","2182.7","0.3","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H28 B20 -","- C11 H28 B20 -","- C44 H112 B80 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0808","0.0714","","","0.2004","0.2089","","","","","","1.102","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078124","12.8235","0.0004","19.04","0.0006","20.2987","0.0006","90","","90","","90","","4956.1","0.3","296","2","296","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C14 H34 B20 -","- C14 H34 B20 -","- C112 H272 B160 -","8","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0699","0.0517","","","0.1408","0.1609","","","","","","1.022","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078125","13.6925","0.0007","13.7304","0.0006","13.7522","0.0006","61.838","0.001","88.833","0.001","77.774","0.001","2218.17","0.18","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C11 H28 B20 -","- C11 H28 B20 -","- C44 H112 B80 -","4","2","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.1368","0.069","","","0.1697","0.2034","","","","","","1.036","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078126","7.066","0.0015","8.4442","0.0017","22.582","0.005","90","","90","","90","","1347.4","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C9 H16 B10 -","- C9 H16 B10 -","- C36 H64 B40 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Reaction of Carboryne with Alkylbenzenes","Organometallics","2012","31","8","3316","","10.1021/om300129t","","","0.71073","MoKα","","0.0835","0.0519","","","0.1287","0.1518","","","","","","1.09","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078127","7.4119","0.0009","8.748","0.003","22.979","0.004","90","","95.218","0.012","90","","1483.8","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 O5 Te2 -","- C14 H14 O5 Te2 -","- C56 H56 O20 Te8 -","4","1","","Beckmann, Jens; Duthie, Andrew; Gesing, Thorsten M.; Koehne, Tim; Lork, Enno","Depolymerization of Aryltellurinic Anhydrides with Sodium Hydroxide. Synthesis and Structure of the Hydrated Sodium Aryltellurinates [Na(H2O)4](RTeO2) (R = 4-MeOC6H4, 8-Me2NC10H6)","Organometallics","2012","31","8","3451","","10.1021/om300130a","","","0.71073","MoKα","","0.0563","0.047","","","0.1127","0.1182","","","","","","1.117","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078128","6.8541","0.0007","5.0843","0.0011","17.21","0.002","90","","95.326","0.009","90","","597.15","0.16","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H15 Na O7 Te -","- C7 H15 Na O7 Te -","- C14 H30 Na2 O14 Te2 -","2","1","","Beckmann, Jens; Duthie, Andrew; Gesing, Thorsten M.; Koehne, Tim; Lork, Enno","Depolymerization of Aryltellurinic Anhydrides with Sodium Hydroxide. Synthesis and Structure of the Hydrated Sodium Aryltellurinates [Na(H2O)4](RTeO2) (R = 4-MeOC6H4, 8-Me2NC10H6)","Organometallics","2012","31","8","3451","","10.1021/om300130a","","","0.71073","MoKα","","0.0276","0.0269","","","0.0694","0.07","","","","","","1.018","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078129","8.631","0.002","10.273","0.001","19.562","0.002","83.3","0.01","89.68","0.01","88.31","0.01","1721.9","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H22 N Na O7 Te -","- C12 H22 N Na O7 Te -","- C48 H88 N4 Na4 O28 Te4 -","4","2","","Beckmann, Jens; Duthie, Andrew; Gesing, Thorsten M.; Koehne, Tim; Lork, Enno","Depolymerization of Aryltellurinic Anhydrides with Sodium Hydroxide. Synthesis and Structure of the Hydrated Sodium Aryltellurinates [Na(H2O)4](RTeO2) (R = 4-MeOC6H4, 8-Me2NC10H6)","Organometallics","2012","31","8","3451","","10.1021/om300130a","","","0.71073","MoKα","","0.0791","0.0438","","","0.0831","0.0945","","","","","","1.009","","","","has coordinates","183806","2020-10-21","18:00:00",""
"4078130","12.4298","0.0006","13.8048","0.0008","15.5245","0.0008","89.869","0.002","71.536","0.001","76.876","0.002","2453.7","0.2","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","","","- C47 H77 Fe2 S2 Si2 -","- C47 H56 Fe2 S2 Si2 -","- C94 H112 Fe4 S4 Si4 -","2","1","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.0492","0.039","","","0.1084","0.1164","","","","","","1.076","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078131","11.1305","0.0004","18.4097","0.0006","15.4573","0.0005","90","","103.257","0.001","90","","3082.94","0.18","173","1","173","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H46 Fe2 N2 S Si -","- C30 H46 Fe2 N2 S Si -","- C120 H184 Fe8 N8 S4 Si4 -","4","1","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.0506","0.0344","","","0.0747","0.0879","","","","","","1.09","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078132","24.6933","0.0005","24.6933","0.0005","13.8075","0.0003","90","","90","","120","","7291.3","0.3","173","1","173","1","","","","","","","","5","P 63","P 6c","173","","","","- C47 H69 Fe2 S3 Si3 -","- C47 H69 Fe2 S3 Si3 -","- C282 H414 Fe12 S18 Si18 -","6","1","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.0439","0.035","","","0.0841","0.0873","","","","","","1.058","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078133","12.763","0.002","18.57","0.003","16.934","0.003","90","","93.351","0.003","90","","4006.6","1.1","103","1","103","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H56 Ru2 S2 Si2 -","- C38 H56 Ru2 S2 Si2 -","- C152 H224 Ru8 S8 Si8 -","4","1","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.0957","0.0702","","","0.1416","0.1559","","","","","","1.133","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078134","11.072","0.002","15.416","0.003","21.854","0.004","95.023","0.004","98.802","0.003","101.281","0.004","3588.4","1.2","103","1","103","1","","","","","","","","8","P -1","-P 1","2","","","","- C31 H47 F3 Fe2 N2 O3 S2 Si -","- C31 H47 F3 Fe2 N2 O3 S2 Si -","- C124 H188 F12 Fe8 N8 O12 S8 Si4 -","4","2","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.0832","0.0582","","","0.1395","0.1633","","","","","","0.942","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078135","10.985","0.001","15.8855","0.0014","15.9669","0.0016","92.938","0.002","107.854","0.003","107.113","0.002","2503.8","0.4","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","","","- C23 H38 Fe S Si2 -","- C22 H36 Fe S Si2 -","- C88 H144 Fe4 S4 Si8 -","4","2","","Yuki, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Synthesis of Sulfur- and Nitrogen-Bridged Diiron Complexes and Catalytic Behavior toward Hydrazines","Organometallics","2012","31","8","2953","","10.1021/om300134t","","","0.71069","MoKα","","0.1441","0.0798","","","0.2024","0.2521","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078136","12.827","0.003","13.963","0.003","17.082","0.003","90","","110.78","0.03","90","","2860.4","1.2","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Fe2 N2 O6 S2 -","- C28 H28 Fe2 N2 O6 S2 -","- C112 H112 Fe8 N8 O24 S8 -","4","1","","Song, Li-Cheng; Gao, Wei; Luo, Xiang; Wang, Zhi-Xuan; Sun, Xiao-Jing; Song, Hai-Bin","Synthesis, Characterization, and Electrochemical Properties of Benzyloxy-Functionalized Diiron 1,3-Propanedithiolate Complexes Relevant to the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","8","3324","","10.1021/om300136b","","","0.71073","MoKα","","0.0662","0.0474","","","0.0981","0.106","","","","","","1.06","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078137","19.185","0.004","14.329","0.003","17.05","0.003","90","","111.33","0.03","90","","4366","1.7","113","2","113","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H43 Fe2 O5 P2 S2 -","- C50 H36 Fe2 O5 P2 S2 -","- C200 H144 Fe8 O20 P8 S8 -","4","0.5","","Song, Li-Cheng; Gao, Wei; Luo, Xiang; Wang, Zhi-Xuan; Sun, Xiao-Jing; Song, Hai-Bin","Synthesis, Characterization, and Electrochemical Properties of Benzyloxy-Functionalized Diiron 1,3-Propanedithiolate Complexes Relevant to the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","8","3324","","10.1021/om300136b","","","0.71073","MoKα","","0.0482","0.0424","","","0.11","0.114","","","","","","1.083","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078138","9.0684","0.0018","37.231","0.007","11.977","0.002","90","","103.17","0.03","90","","3937.4","1.4","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H39 Fe2 O6.5 P2 S2 -","- C35 H36 Fe2 O6.5 P2 S2 -","- C140 H144 Fe8 O26 P8 S8 -","4","1","","Song, Li-Cheng; Gao, Wei; Luo, Xiang; Wang, Zhi-Xuan; Sun, Xiao-Jing; Song, Hai-Bin","Synthesis, Characterization, and Electrochemical Properties of Benzyloxy-Functionalized Diiron 1,3-Propanedithiolate Complexes Relevant to the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","8","3324","","10.1021/om300136b","","","0.71073","MoKα","","0.0555","0.0499","","","0.1511","0.1555","","","","","","1.115","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078139","11.158","0.012","22.76","0.02","14.644","0.015","90","","97.067","0.014","90","","3691","6","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 Fe2 O5 P2 S2 -","- C40 H36 Fe2 O5 P2 S2 -","- C160 H144 Fe8 O20 P8 S8 -","4","1","","Song, Li-Cheng; Gao, Wei; Luo, Xiang; Wang, Zhi-Xuan; Sun, Xiao-Jing; Song, Hai-Bin","Synthesis, Characterization, and Electrochemical Properties of Benzyloxy-Functionalized Diiron 1,3-Propanedithiolate Complexes Relevant to the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","8","3324","","10.1021/om300136b","","","0.7107","MoKα","","0.1049","0.0797","","","0.2242","0.2358","","","","","","1.046","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078140","11.922","0.002","12.398","0.003","12.817","0.003","84.903","0.017","67.969","0.012","66.568","0.013","1607.3","0.6","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H26 Cl2 Fe2 O6 P S2 -","- C29 H26 Cl2 Fe2 O6 P S2 -","- C58 H52 Cl4 Fe4 O12 P2 S4 -","2","1","","Song, Li-Cheng; Gao, Wei; Luo, Xiang; Wang, Zhi-Xuan; Sun, Xiao-Jing; Song, Hai-Bin","Synthesis, Characterization, and Electrochemical Properties of Benzyloxy-Functionalized Diiron 1,3-Propanedithiolate Complexes Relevant to the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","8","3324","","10.1021/om300136b","","","0.7107","MoKα","","0.0848","0.0651","","","0.1873","0.2293","","","","","","0.84","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078141","10.367","0.0012","6.6771","0.0007","13.6406","0.0015","90","","93.131","0.002","90","","942.81","0.18","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H26 Cl N O2 Os -","- C20 H26 Cl N O2 Os -","- C40 H52 Cl2 N2 O4 Os2 -","2","1","","Carmona, Daniel; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.; Lamata, M. Pilar; Viguri, Fernando","Half-Sandwich Complexes of Osmium(II) withl-α-Amino Carboxylate Ligands as Asymmetric Transfer Hydrogenation Catalysts. On the Origin of the Enantioselectivity","Organometallics","2012","31","8","3333","","10.1021/om3001394","","","0.71073","MoKα","","0.0475","0.039","","","0.0801","0.0828","","","","","","0.955","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078142","6.5418","0.0006","10.4418","0.0009","23.02","0.002","90","","90","","90","","1572.5","0.2","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 Cl N O2 Os -","- C15 H20 Cl N O2 Os -","- C60 H80 Cl4 N4 O8 Os4 -","4","1","","Carmona, Daniel; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.; Lamata, M. Pilar; Viguri, Fernando","Half-Sandwich Complexes of Osmium(II) withl-α-Amino Carboxylate Ligands as Asymmetric Transfer Hydrogenation Catalysts. On the Origin of the Enantioselectivity","Organometallics","2012","31","8","3333","","10.1021/om3001394","","","0.71073","MoKα","","0.0695","0.0458","","","0.0738","0.0788","","","","","","0.862","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078143","6.196","0.0005","14.6441","0.0011","17.7441","0.0014","90","","90","","90","","1610","0.2","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 Cl N O2 Os -","- C16 H24 Cl N O2 Os -","- C64 H96 Cl4 N4 O8 Os4 -","4","1","","Carmona, Daniel; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.; Lamata, M. Pilar; Viguri, Fernando","Half-Sandwich Complexes of Osmium(II) withl-α-Amino Carboxylate Ligands as Asymmetric Transfer Hydrogenation Catalysts. On the Origin of the Enantioselectivity","Organometallics","2012","31","8","3333","","10.1021/om3001394","","","0.71073","MoKα","","0.0325","0.0297","","","0.0549","0.0557","","","","","","1.001","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078144","15.016","0.016","19.85","0.02","20.5","0.02","90","","90","","90","","6110","11","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C48 H75 B3 F12 N3 O7.5 Os3 -","- C48 H66 B3 F12 N3 O7.5 Os3 -","- C192 H264 B12 F48 N12 O30 Os12 -","4","1","","Carmona, Daniel; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.; Lamata, M. Pilar; Viguri, Fernando","Half-Sandwich Complexes of Osmium(II) withl-α-Amino Carboxylate Ligands as Asymmetric Transfer Hydrogenation Catalysts. On the Origin of the Enantioselectivity","Organometallics","2012","31","8","3333","","10.1021/om3001394","","","0.71073","MoKα","","0.1942","0.0651","","","0.1153","0.131","","","","","","0.807","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078145","15.43","0.002","15.43","0.002","58.65","0.012","90","","90","","90","","13964","4","173","2","173","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C52 H82 B3 F12 N3 O7 Os3 -","- C52 H72 B3 F12 N3 O7 Os3 -","- C416 H576 B24 F96 N24 O56 Os24 -","8","1","","Carmona, Daniel; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.; Lamata, M. Pilar; Viguri, Fernando","Half-Sandwich Complexes of Osmium(II) withl-α-Amino Carboxylate Ligands as Asymmetric Transfer Hydrogenation Catalysts. On the Origin of the Enantioselectivity","Organometallics","2012","31","8","3333","","10.1021/om3001394","","","0.71073","MoKα","","0.1061","0.0584","","","0.1121","0.1227","","","","","","0.893","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078146","11.596","0.003","21.607","0.005","20.596","0.005","90","","96.34","0.004","90","","5129","2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H69 N7 S Si2 Zr -","- C52 H69 N7 S Si2 Zr -","- C208 H276 N28 S4 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Plundrich, Gudrun T.; Wadepohl, Hubert; Gade, Lutz H.","[2 + 2] Cycloaddition Products of Zirconium and Hafnium Hydrazinediides with Allenes and Heteroallenes and Their Thermally Induced Rearrangements","Organometallics","2012","31","8","3346","","10.1021/om300143h","","x-ray","0.71073","MoKα","","0.1067","0.054","","","0.1292","0.1488","","","","","","1.107","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078147","11.392","0.006","21.888","0.011","22.235","0.011","90","","103.007","0.007","90","","5402","5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H75 N7 S Si2 Zr -","- C55 H75 N7 S Si2 Zr -","- C220 H300 N28 S4 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Plundrich, Gudrun T.; Wadepohl, Hubert; Gade, Lutz H.","[2 + 2] Cycloaddition Products of Zirconium and Hafnium Hydrazinediides with Allenes and Heteroallenes and Their Thermally Induced Rearrangements","Organometallics","2012","31","8","3346","","10.1021/om300143h","","x-ray","0.71073","MoKα","","0.0485","0.0359","","","0.0837","0.0925","","","","","","1.03","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078148","11.14","0.005","22.176","0.01","19.373","0.008","90","","104.619","0.01","90","","4631","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47 H64 N6 Si2 Zr -","- C47 H64 N6 Si2 Zr -","- C188 H256 N24 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Plundrich, Gudrun T.; Wadepohl, Hubert; Gade, Lutz H.","[2 + 2] Cycloaddition Products of Zirconium and Hafnium Hydrazinediides with Allenes and Heteroallenes and Their Thermally Induced Rearrangements","Organometallics","2012","31","8","3346","","10.1021/om300143h","","x-ray","0.71073","MoKα","","0.0454","0.0322","","","0.0759","0.0844","","","","","","1.058","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078149","11.179","0.006","23.599","0.012","20.213","0.01","90","","91.2","0.009","90","","5331","5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H84 Hf N6 Si2 -","- C53 H84 Hf N6 Si2 -","- C212 H336 Hf4 N24 Si8 -","4","1","","Gehrmann, Thorsten; Plundrich, Gudrun T.; Wadepohl, Hubert; Gade, Lutz H.","[2 + 2] Cycloaddition Products of Zirconium and Hafnium Hydrazinediides with Allenes and Heteroallenes and Their Thermally Induced Rearrangements","Organometallics","2012","31","8","3346","","10.1021/om300143h","","x-ray","0.71073","MoKα","","0.0499","0.0325","","","0.0638","0.0708","","","","","","1.034","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078150","10.0071","0.0003","11.2824","0.0003","19.3538","0.0006","78.416","0.004","82.15","0.004","72.009","0.004","2029.42","0.12","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H54 F3 N3 O6 Pd S -","- C37 H54 F3 N3 O6 Pd S -","- C74 H108 F6 N6 O12 Pd2 S2 -","2","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd‒C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","0.71073","MoKα","","0.0365","0.0267","","","0.0663","0.0676","","","","","","0.949","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078151","8.7948","0.0011","9.8117","0.001","11.3509","0.0013","104.998","0.01","103.082","0.01","104.619","0.01","869.8","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H17 N O2 -","- C23 H17 N O2 -","- C46 H34 N2 O4 -","2","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd‒C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","1.54184","CuKα","","0.0459","0.0398","","","0.1072","0.111","","","","","","1.081","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078152","11.1524","0.0004","10.1077","0.0004","11.2671","0.0004","90","","91.129","0.004","90","","1269.84","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd‒C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","1.54184","CuKα","","0.0406","0.0352","","","0.0871","0.0909","","","","","","1.038","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078153","8.3426","0.0002","9.746","0.0003","17.8648","0.0004","81.605","0.003","83.119","0.003","74.056","0.003","1376.83","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H34 N4 O Pd -","- C29 H34 N4 O Pd -","- C58 H68 N8 O2 Pd2 -","2","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd‒C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","0.71073","MoKα","","0.0226","0.0188","","","0.0487","0.0493","","","","","","1.065","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078154","15.4806","0.0005","8.6812","0.0003","18.5378","0.0006","90","","106.395","0.004","90","","2390","0.15","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H26 N2 O -","- C31 H26 N2 O -","- C124 H104 N8 O4 -","4","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd–C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","0.71073","MoKα","","0.0579","0.0368","","","0.0829","0.0867","","","","","","0.926","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078155","11.2983","0.0004","8.6519","0.0003","37.1625","0.0012","90","","97.241","0.004","90","","3603.7","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H43 Cl N4 Pd -","- C41 H43 Cl N4 Pd -","- C164 H172 Cl4 N16 Pd4 -","4","1","","Frutos-Pedreño, Roberto; González-Herrero, Pablo; Vicente, José; Jones, Peter G.","Sequential Insertion of Alkynes and CO or Isocyanides into the Pd‒C Bond of Cyclopalladated Phenylacetamides. Synthesis of Eight-Membered Palladacycles, Benzo[d]azocine-2,4(1H,3H)-diones, and Highly Functionalized Acrylonitrile and Acrylamide Derivatives","Organometallics","2012","31","8","3361","","10.1021/om300151n","","","1.54184","CuKα","","0.0373","0.0346","","","0.0857","0.0875","","","","","","1.054","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078156","33.59","0.003","33.59","0.003","13.3249","0.0012","90","","90","","120","","13020","2","150","2","150","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","MAAC","","","- C31.5 H48 N2 O -","- C24 H30 N2 O -","- C432 H540 N36 O18 -","18","1","","Blake, Garrett A.; Moerdyk, Jonathan P.; Bielawski, Christopher W.","Tuning the Electronic Properties of Carbenes: A Systematic Comparison of Neighboring Amino versus Amido Groups","Organometallics","2012","31","8","3373","","10.1021/om3001586","","","0.71075","MoKα","","0.1299","0.0663","","","0.1357","0.1567","","","","","","0.885","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078157","11.756","0.003","9.387","0.002","26.214","0.006","90","","97.739","0.005","90","","2866.5","1.2","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","MAACIrCODCl","","","- C32 H42 Cl Ir N2 O -","- C32 H42 Cl Ir N2 O -","- C128 H168 Cl4 Ir4 N8 O4 -","4","1","","Blake, Garrett A.; Moerdyk, Jonathan P.; Bielawski, Christopher W.","Tuning the Electronic Properties of Carbenes: A Systematic Comparison of Neighboring Amino versus Amido Groups","Organometallics","2012","31","8","3373","","10.1021/om3001586","","","0.71075","MoKα","","0.0399","0.0374","","","0.0845","0.086","","","","","","1.006","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078158","22.584","0.002","22.584","0.002","10.3184","0.0011","90","","90","","120","","4557.7","0.7","150","2","150","2","","","","","","","","5","P 61","P 61","169","6satMe2MesIrCODCl","","","- C32 H44 Cl Ir N2 -","- C32 H44 Cl Ir N2 -","- C192 H264 Cl6 Ir6 N12 -","6","1","","Blake, Garrett A.; Moerdyk, Jonathan P.; Bielawski, Christopher W.","Tuning the Electronic Properties of Carbenes: A Systematic Comparison of Neighboring Amino versus Amido Groups","Organometallics","2012","31","8","3373","","10.1021/om3001586","","","0.71075","MoKα","","0.02","0.0185","","","0.0521","0.0536","","","","","","1.006","","","","has coordinates,has disorder","178670","2020-10-21","18:00:00",""
"4078159","9.2202","0.0008","26.635","0.002","10.247","0.0009","90","","94.477","0.002","90","","2508.8","0.4","298","2","298","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 Cl F6 N P Rh S -","- C22 H26 Cl F6 N P Rh S -","- C88 H104 Cl4 F24 N4 P4 Rh4 S4 -","4","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0726","0.0665","","","0.1408","0.1438","","","","","","1.264","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078160","22.802","0.008","8.224","0.003","26.023","0.008","90","","95.596","0.006","90","","4857","3","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C21 H25 Cl F6 N2 P Rh S -","- C21 H25 Cl F6 N2 P Rh S -","- C168 H200 Cl8 F48 N16 P8 Rh8 S8 -","8","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0721","0.0585","","","0.1245","0.1309","","","","","","1.176","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078161","13.709","0.002","14.199","0.002","31.494","0.005","90","","90","","90","","6130.4","1.6","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H29 F12 N2 P2 Rh Se -","- C24 H29 F12 N2 P2 Rh Se -","- C192 H232 F96 N16 P16 Rh8 Se8 -","8","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0982","0.083","","","0.1992","0.208","","","","","","1.172","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078162","23.185","0.004","8.5541","0.0014","25.652","0.004","90","","95.84","0.003","90","","5061.1","1.4","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H26 Cl F6 Ir N P S -","- C22 H26 Cl F6 Ir N P S -","- C176 H208 Cl8 F48 Ir8 N8 P8 S8 -","8","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0443","0.0397","","","0.0837","0.0857","","","","","","1.181","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078163","23.319","0.004","8.6267","0.0013","25.61","0.004","90","","94.343","0.003","90","","5137.1","1.4","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H26 Cl F6 Ir N P Se -","- C22 H26 Cl F6 Ir N P Se -","- C176 H208 Cl8 F48 Ir8 N8 P8 Se8 -","8","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0546","0.0475","","","0.113","0.117","","","","","","1.064","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078164","22.849","0.013","8.306","0.004","26.097","0.013","90","","95.934","0.015","90","","4926","4","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C21 H25 Cl F6 Ir N2 P S -","- C21 H25 Cl F6 Ir N2 P S -","- C168 H200 Cl8 F48 Ir8 N16 P8 S8 -","8","1","","Prakash, Om; Singh, Pradhumn; Mukherjee, G.; Singh, Ajai K.","Efficient Catalysis of Transfer Hydrogenation of Ketones and Oxidation of Alcohols with Newly Designed Half-Sandwich Rhodium(III) and Iridium(III) Complexes of Half-Pincer Chalcogenated Pyridines","Organometallics","2012","31","8","3379","","10.1021/om300169p","","","0.71073","MoKα","","0.0663","0.0533","","","0.113","0.1291","","","","","","1.112","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078165","14.432","0.003","9.732","0.002","15.683","0.004","90","","108.605","0.005","90","","2087.6","0.8","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Ge N2 O S -","- C19 H32 Ge N2 O S -","- C76 H128 Ge4 N8 O4 S4 -","4","1","","Siwatch, Rahul Kumar; Nagendran, Selvarajan","Germaester Complexes with a Ge(E)Ot-Bu Moiety (E = S or Se)","Organometallics","2012","31","8","3389","","10.1021/om300173s","","","0.71073","MoKα","","0.0793","0.0503","","","0.1202","0.1467","","","","","","1.003","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078166","12.181","0.002","10.694","0.002","17.532","0.003","90","","102.975","0.004","90","","2225.5","0.7","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Ge N2 O S -","- C19 H32 Ge N2 O S -","- C76 H128 Ge4 N8 O4 S4 -","4","1","","Siwatch, Rahul Kumar; Nagendran, Selvarajan","Germaester Complexes with a Ge(E)Ot-Bu Moiety (E = S or Se)","Organometallics","2012","31","8","3389","","10.1021/om300173s","","","0.71073","MoKα","","0.1026","0.0843","","","0.1627","0.172","","","","","","1.17","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078167","14.928","0.003","9.654","0.002","15.48","0.003","90","","107.129","0.004","90","","2131.9","0.7","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Ge N2 O Se -","- C19 H32 Ge N2 O Se -","- C76 H128 Ge4 N8 O4 Se4 -","4","1","","Siwatch, Rahul Kumar; Nagendran, Selvarajan","Germaester Complexes with a Ge(E)Ot-Bu Moiety (E = S or Se)","Organometallics","2012","31","8","3389","","10.1021/om300173s","","","0.71073","MoKα","","0.0661","0.0529","","","0.108","0.1129","","","","","","1.222","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078168","12.504","0.007","10.814","0.006","17.158","0.01","90","","104.104","0.011","90","","2250","2","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Ge N2 O Se -","- C19 H32 Ge N2 O Se -","- C76 H128 Ge4 N8 O4 Se4 -","4","1","","Siwatch, Rahul Kumar; Nagendran, Selvarajan","Germaester Complexes with a Ge(E)Ot-Bu Moiety (E = S or Se)","Organometallics","2012","31","8","3389","","10.1021/om300173s","","","0.71073","MoKα","","0.0663","0.0411","","","0.0862","0.0941","","","","","","0.953","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078169","9.664","0.002","16.871","0.005","21.112","0.008","90","","90","","90","","3442.1","1.8","173","2","173","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C39 H42 Fe I N P2 -","- C39 H42 Fe I N P2 -","- C156 H168 Fe4 I4 N4 P8 -","4","1","","Brunner, Henri; Kurosawa, Takaki; Muschiol, Manfred; Tsuno, Takashi; Ike, Hayato","16- and 17-Electron Intermediates in the MeCN/RNC Exchange in Chiral-at-Metal [CpFe(Prophos)NCMe]X (X = I, PF6)","Organometallics","2012","31","8","3395","","10.1021/om3001789","","x-ray","0.71073","MoKα","","0.1056","0.0704","","","0.164","0.1846","","","","","","1.074","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078170","11.063","0.003","14.721","0.004","11.631","0.004","90","","117.106","0.015","90","","1686.2","0.9","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C39 H42 Fe I N P2 -","- C39 H42 Fe I N P2 -","- C78 H84 Fe2 I2 N2 P4 -","2","1","","Brunner, Henri; Kurosawa, Takaki; Muschiol, Manfred; Tsuno, Takashi; Ike, Hayato","16- and 17-Electron Intermediates in the MeCN/RNC Exchange in Chiral-at-Metal [CpFe(Prophos)NCMe]X (X = I, PF6)","Organometallics","2012","31","8","3395","","10.1021/om3001789","","x-ray","0.71073","MoKα","","0.0399","0.035","","","0.0774","0.0801","","","","","","1.046","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078171","10.01","0.004","17.66","0.006","10.919","0.004","90","","110.235","0.016","90","","1811.1","1.2","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C39 H42 F6 Fe N P3 -","- C39 H42 F6 Fe N P3 -","- C78 H84 F12 Fe2 N2 P6 -","2","1","","Brunner, Henri; Kurosawa, Takaki; Muschiol, Manfred; Tsuno, Takashi; Ike, Hayato","16- and 17-Electron Intermediates in the MeCN/RNC Exchange in Chiral-at-Metal [CpFe(Prophos)NCMe]X (X = I, PF6)","Organometallics","2012","31","8","3395","","10.1021/om3001789","","x-ray","0.71073","MoKα","","0.0407","0.038","","","0.091","0.0922","","","","","","1.041","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078172","9.828","0.003","16.854","0.003","20.244","0.005","90","","90","","90","","3353.2","1.4","173","2","173","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H40 Fe I N P2 -","- C37 H40 Fe I N P2 -","- C148 H160 Fe4 I4 N4 P8 -","4","1","","Brunner, Henri; Kurosawa, Takaki; Muschiol, Manfred; Tsuno, Takashi; Ike, Hayato","16- and 17-Electron Intermediates in the MeCN/RNC Exchange in Chiral-at-Metal [CpFe(Prophos)NCMe]X (X = I, PF6)","Organometallics","2012","31","8","3395","","10.1021/om3001789","","x-ray","0.71073","MoKα","","0.0519","0.0397","","","0.0822","0.0864","","","","","","1.064","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078173","10.202","0.003","17.204","0.005","11.28","0.003","90","","114.659","0.01","90","","1799.3","0.9","173","2","173","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C37 H40 F6 Fe N P3 -","- C37 H40 F6 Fe N P3 -","- C74 H80 F12 Fe2 N2 P6 -","2","1","","Brunner, Henri; Kurosawa, Takaki; Muschiol, Manfred; Tsuno, Takashi; Ike, Hayato","16- and 17-Electron Intermediates in the MeCN/RNC Exchange in Chiral-at-Metal [CpFe(Prophos)NCMe]X (X = I, PF6)","Organometallics","2012","31","8","3395","","10.1021/om3001789","","x-ray","0.71073","MoKα","","0.2153","0.103","","","0.1668","0.2065","","","","","","0.97","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078174","14.2808","0.0019","10.8004","0.0014","19.383","0.003","90","","98.592","0.003","90","","2956.1","0.7","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H37 Fe Ge N O S -","- C32 H37 Fe Ge N O S -","- C128 H148 Fe4 Ge4 N4 O4 S4 -","4","1","","Kamitani, Masahiro; Fukumoto, Kozo; Tada, Ryosuke; Itazaki, Masumi; Nakazawa, Hiroshi","Catalytic Synthesis of Cyclic and Linear Germoxanes Mediated by an Iron Complex","Organometallics","2012","31","8","2957","","10.1021/om3001845","","","0.7107","MoKα","","0.0591","0.0469","","","0.0816","0.0846","","","","","","1.162","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078175","17.935","0.011","13.488","0.008","26.855","0.016","90","","95.412","0.009","90","","6467","7","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H69 Cl N2 O2 Pd -","- C80 H69 Cl N2 O2 Pd -","- C320 H276 Cl4 N8 O8 Pd4 -","4","1","","Meiries, Sebastien; Chartoire, Anthony; Slawin, Alexandra M. Z.; Nolan, Steven P.","[Pd(IPr*)(acac)Cl]: An Easily Synthesized, Bulky Precatalyst for C‒N Bond Formation","Organometallics","2012","31","8","3402","","10.1021/om300205c","","","0.71073","MoKα","","0.189","0.1497","","","0.3676","0.3876","","","","","","1.175","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078176","7.202","0.0004","8.2457","0.0005","16.4105","0.0009","90","","93.2572","0.0015","90","","972.97","0.1","93","","93","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H25 O4 P -","- C22 H25 O4 P -","- C44 H50 O8 P2 -","2","1","","Motoyama, Kazuki; Ikeda, Masahiro; Miyake, Yoshihiro; Nishibayashi, Yoshiaki","Ruthenium- and Copper-Catalyzed Enantioselective Propargylic Alkylation of Propargylic Alcohols with β-Keto Phosphonates","Organometallics","2012","31","8","3426","","10.1021/om300219f","","","0.71075","MoKα","","","0.0343","","","","0.0808","","","","","","1","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078177","12.0376","0.0004","12.6331","0.0004","12.9189","0.0004","69.683","0.001","78.064","0.001","84.682","0.001","1802.08","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H21 Au O10 Os3 P -","- C34 H21 Au O10 Os3 P -","- C68 H42 Au2 O20 Os6 P2 -","2","1","","Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang","Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands","Organometallics","2012","31","8","2961","","10.1021/om300235n","","","0.71073","MoKα","","0.046","0.038","","","0.1018","0.1092","","","","","","1.033","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078178","9.4965","0.0002","12.8917","0.0003","28.5192","0.0006","86.469","0.001","86.732","0.001","88.964","0.001","3478.83","0.13","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H20 Au O9 Os3 P -","- C33 H20 Au O9 Os3 P -","- C132 H80 Au4 O36 Os12 P4 -","4","2","","Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang","Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands","Organometallics","2012","31","8","2961","","10.1021/om300235n","","","0.71073","MoKα","","0.0513","0.0368","","","0.0834","0.0917","","","","","","1.031","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078179","9.2085","0.0006","15.4986","0.0011","15.6967","0.0011","69.71","0.001","87.315","0.001","82.697","0.001","2084.2","0.2","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H29 Au O10 Os3 P -","- C41 H29 Au O10 Os3 P -","- C82 H58 Au2 O20 Os6 P2 -","2","1","","Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang","Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands","Organometallics","2012","31","8","2961","","10.1021/om300235n","","","0.71073","MoKα","","0.0518","0.0404","","","0.1121","0.122","","","","","","1.025","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078180","30.52","0.003","10.1912","0.0008","27.194","0.003","90","","115.246","0.004","90","","7650.4","1.3","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H22 Au O10 Os3 P -","- C38 H22 Au O10 Os3 P -","- C304 H176 Au8 O80 Os24 P8 -","8","1","","Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang","Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands","Organometallics","2012","31","8","2961","","10.1021/om300235n","","","0.71073","MoKα","","0.0611","0.0444","","","0.0986","0.1073","","","","","","1.073","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078181","9.1719","0.0005","16.0279","0.0009","25.9591","0.0014","90","","91.298","0.001","90","","3815.2","0.4","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H22 Au O9 Os3 P -","- C37 H22 Au O9 Os3 P -","- C148 H88 Au4 O36 Os12 P4 -","4","1","","Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang","Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands","Organometallics","2012","31","8","2961","","10.1021/om300235n","","","0.71073","MoKα","","0.0599","0.0435","","","0.1022","0.1107","","","","","","1.053","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078182","9.104","0.003","11.125","0.004","16.529","0.006","96.254","0.013","90.176","0.009","92.435","0.011","1662.6","1","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H25 Br2 Cl6 Fe N3 -","- C30 H25 Br2 Cl6 Fe N3 -","- C60 H50 Br4 Cl12 Fe2 N6 -","2","1","","Kamata, Kouji; Suzuki, Atsuko; Nakai, Yuta; Nakazawa, Hiroshi","Catalytic Hydrosilylation of Alkenes by Iron Complexes Containing Terpyridine Derivatives as Ancillary Ligands","Organometallics","2012","31","10","3825","3828","10.1021/om300279t","","","0.7107","MoKα","","0.1148","0.0871","","","0.185","0.1979","","","","","","1.193","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078183","12.144","0.002","15.685","0.003","14.4","0.003","90","","105.016","0.004","90","","2649.2","0.9","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H25 Br2 Cl2 Fe N3 -","- C26 H25 Br2 Cl2 Fe N3 -","- C104 H100 Br8 Cl8 Fe4 N12 -","4","1","","Kamata, Kouji; Suzuki, Atsuko; Nakai, Yuta; Nakazawa, Hiroshi","Catalytic Hydrosilylation of Alkenes by Iron Complexes Containing Terpyridine Derivatives as Ancillary Ligands","Organometallics","2012","31","10","3825","3828","10.1021/om300279t","","","0.7107","MoKα","","0.1031","0.0779","","","0.1029","0.1095","","","","","","1.182","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078184","18.532","0.0004","15.384","0.0004","18.897","0.0004","90","","109.264","0.0014","90","","5085.8","0.2","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H76 B2 F8 N6 O P2 Rh2 -","- C41 H76 B2 F8 N6 O P2 Rh2 -","- C164 H304 B8 F32 N24 O4 P8 Rh8 -","4","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0602","0.0392","","","0.074","0.0806","","","","","","1.081","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078185","11.156","0.0001","14.334","0.0002","16.529","0.0003","90","","90.163","0.0006","90","","2643.14","0.06","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C22 H41 B F4 N2 O P Rh -","- C22 H41 B F4 N2 O P Rh -","- C88 H164 B4 F16 N8 O4 P4 Rh4 -","4","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0432","0.0322","","","0.0768","0.082","","","","","","1.03","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078186","7.817","0.0001","11.8504","0.0002","13.9795","0.0002","74.3341","0.001","74.2262","0.001","85.5839","0.0006","1199.92","0.03","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H39 B F4 N2 P Rh -","- C21 H39 B F4 N2 P Rh -","- C42 H78 B2 F8 N4 P2 Rh2 -","2","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0334","0.0305","","","0.0744","0.0764","","","","","","1.099","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078187","11.6467","0.0005","16.1779","0.0008","13.947","0.0008","90","","104.855","0.003","90","","2540.1","0.2","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H39 B F4 N P2 Rh -","- C21 H39 B F4 N P2 Rh -","- C84 H156 B4 F16 N4 P8 Rh4 -","4","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0843","0.0468","","","0.0953","0.1102","","","","","","0.958","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078188","14.1476","0.0005","24.9498","0.0009","7.5796","0.0003","90","","90","","90","","2675.45","0.17","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H39 Cl2 N3 P Rh -","- C25 H39 Cl2 N3 P Rh -","- C100 H156 Cl8 N12 P4 Rh4 -","4","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0429","0.0377","","","0.0858","0.0881","","","","","","1.034","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078189","10.6386","0.0002","15.196","0.0002","18.7985","0.0003","74.9166","0.0007","84.3107","0.0007","72.6717","0.0006","2800.39","0.08","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H42 B F4 N3 P Rh -","- C25 H42 B F4 N3 P Rh -","- C100 H168 B4 F16 N12 P4 Rh4 -","4","2","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0769","0.0526","","","0.1318","0.1498","","","","","","1.104","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078190","11.5987","0.0004","21.1484","0.0007","11.7603","0.0004","90","","102.226","0.001","90","","2819.3","0.17","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H42 B F4 N2 P2 Rh -","- C25 H42 B F4 N2 P2 Rh -","- C100 H168 B4 F16 N8 P8 Rh4 -","4","1","","Feller, Moran; Diskin-Posner, Yael; Shimon, Linda J. W.; Ben-Ari, Eyal; Milstein, David","N–H Activation by Rh(I) via Metal–Ligand Cooperation","Organometallics","2012","31","11","4083","4101","10.1021/om300248r","","","0.71073","MoKα","","0.0454","0.0288","","","0.0639","0.0708","","","","","","1.015","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078191","11.055","0.005","11.533","0.005","11.605","0.005","75.055","0.005","87.816","0.005","62.785","0.005","1265.8","1","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C29 H30 Al N -","- C29 H30 Al N -","- C58 H60 Al2 N2 -","2","1","","Zheng, Wenjun; Pi, Chengfu; Wu, Haishun","An Alkynylaminomethylaluminum Species with a Six-Membered Chair Conformation Al2C2N2Framework: A New Path to Geminal N/Al Frustrated Lewis Pairs","Organometallics","2012","31","10","4072","","10.1021/om200967e","","","","","","0.088","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078192","9.892","0.007","10","0.006","16.95","0.006","92.02","0.04","103.59","0.04","117.61","0.04","1423.8","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H24 Cl2 Ga2 N2 O4 -","- C29 H24 Cl2 Ga2 N2 O4 -","- C58 H48 Cl4 Ga4 N4 O8 -","2","1","","Kushwah, Nisha; Pal, Manoj K.; Wadawale, Amey; Sudarsan, V.; Manna, Debashree; Ghanty, Tapan K.; Jain, Vimal K.","Synthesis, Characterization, Photoluminescence, and Computational Studies of Monoorgano-Gallium and -Indium Complexes Containing Dianionic Tridentate ONE (E = O or S) Schiff Bases","Organometallics","2012","31","10","3836","","10.1021/om201030d","","","0.71069","MoKα","","0.1332","0.0591","","","0.1491","0.1958","","","","","","1.017","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078193","7.711","0.002","10","0.008","11.826","0.003","95.25","0.04","96.89","0.02","111.19","0.03","835.1","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H32 Cl4 Ga2 N2 O6 -","- C32 H32 Cl4 Ga2 N2 O6 -","- C32 H32 Cl4 Ga2 N2 O6 -","1","0.5","","Kushwah, Nisha; Pal, Manoj K.; Wadawale, Amey; Sudarsan, V.; Manna, Debashree; Ghanty, Tapan K.; Jain, Vimal K.","Synthesis, Characterization, Photoluminescence, and Computational Studies of Monoorgano-Gallium and -Indium Complexes Containing Dianionic Tridentate ONE (E = O or S) Schiff Bases","Organometallics","2012","31","10","3836","","10.1021/om201030d","","","0.71069","MoKα","","0.0749","0.0455","","","0.1147","0.1286","","","","","","0.997","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078194","15.9761","0.0019","13.5978","0.0016","18.897","0.002","90","","90","","90","","4105.2","0.8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C19 H20 Cl2 Cu Hg N2 O2 -","- C19 H20 Cl2 Cu Hg N2 O2 -","- C152 H160 Cl16 Cu8 Hg8 N16 O16 -","8","1","","Biswas, Saptarshi; Saha, Rajat; Ghosh, Ashutosh","Copper(II)‒Mercury(II) Heterometallic Complexes Derived from a Salen-Type Ligand: A New Coordination Mode of the Old Schiff Base Ligand","Organometallics","2012","31","10","3844","","10.1021/om201033q","","","0.71073","MoKα","","0.0577","0.0338","","","0.0826","0.0942","","","","","","1.025","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078195","20.64","0.0011","10.3043","0.0005","17.9554","0.0009","90","","91.095","0.002","90","","3818.1","0.3","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C38 H40 Cl2 Cu2 Hg N4 O4 -","- C38 H40 Cl2 Cu2 Hg N4 O4 -","- C152 H160 Cl8 Cu8 Hg4 N16 O16 -","4","1","","Biswas, Saptarshi; Saha, Rajat; Ghosh, Ashutosh","Copper(II)‒Mercury(II) Heterometallic Complexes Derived from a Salen-Type Ligand: A New Coordination Mode of the Old Schiff Base Ligand","Organometallics","2012","31","10","3844","","10.1021/om201033q","","","0.71073","MoKα","","0.1488","0.0761","","","0.1862","0.2271","","","","","","1.024","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078196","9.378","0.005","9.902","0.005","20.42","0.005","90","","91.009","0.005","90","","1895.9","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H38 Cl2 Cu2 Hg2 N4 O4 -","- C38 H38 Cl2 Cu2 Hg2 N4 O4 -","- C76 H76 Cl4 Cu4 Hg4 N8 O8 -","2","0.5","","Biswas, Saptarshi; Saha, Rajat; Ghosh, Ashutosh","Copper(II)‒Mercury(II) Heterometallic Complexes Derived from a Salen-Type Ligand: A New Coordination Mode of the Old Schiff Base Ligand","Organometallics","2012","31","10","3844","","10.1021/om201033q","","","0.71073","MoKα","","0.1122","0.1074","","","0.296","0.2985","","","","","","1.178","","","","has coordinates","178670","2020-10-21","18:00:00",""
"4078197","13.2772","0.0009","13.791","0.0008","18.256","0.001","90","","102.145","0.001","90","","3268","0.3","150.1","","150","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C30 H52 Si4 -","- C30 H52 Si4 -","- C120 H208 Si16 -","4","1","","Naka, Akinobu; Ohshita, Joji; Miyazaki, Eigo; Miura, Toshiko; Kobayashi, Hisayoshi; Ishikawa, Mitsuo","Stereochemistry of Disilanylene-Containing Cyclic Compounds. Palladium-Catalyzed Reactions ofcis- andtrans-3,4-Benzo-1,2-diisopropyl-1,2-dimethyl-1,2-disilacyclobut-3-ene with Ethylene","Organometallics","2012","31","9","3492","","10.1021/om201061x","","","0.7107","MoKα","","","0.102","","","","0.116","","","","","","3.165","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078198","11.4827","0.0003","19.1784","0.0004","29.1806","0.0006","90","","91.6079","0.0006","90","","6423.6","0.3","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H52 Si4 -","- C30 H52 Si4 -","- C240 H416 Si32 -","8","2","","Naka, Akinobu; Ohshita, Joji; Miyazaki, Eigo; Miura, Toshiko; Kobayashi, Hisayoshi; Ishikawa, Mitsuo","Stereochemistry of Disilanylene-Containing Cyclic Compounds. Palladium-Catalyzed Reactions ofcis- andtrans-3,4-Benzo-1,2-diisopropyl-1,2-dimethyl-1,2-disilacyclobut-3-ene with Ethylene","Organometallics","2012","31","9","3492","","10.1021/om201061x","","","0.71069","MoKα","","0.052","0.0446","","","0.1455","0.1545","","","","","","1.247","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078199","18.4364","0.0005","10.8024","0.0003","23.5115","0.0006","90","","95.386","0.001","90","","4661.8","0.2","123","1","123","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C104 H138 Nd2 O12 -","- C103.976 H138 Nd2 O12 -","- C207.952 H276 Nd4 O24 -","2","0.5","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.71073","MoKα","","0.0883","0.0515","","","0.1006","0.1142","","","","","","1.044","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078200","14.669","0.005","14.669","0.005","30.439","0.009","90","","90","","90","","6550","4","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C52 H80 N4 O4 Yb2 -","- C52 H80 N4 O4 Yb2 -","- C208 H320 N16 O16 Yb8 -","4","0.25","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.77487","Synchrotron","","0.0488","0.0428","","","0.1114","0.1158","","","","","","1.08","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078201","13.983","0.003","14.142","0.003","14.351","0.003","116.3","0.03","91.35","0.03","119.31","0.03","2110.9","1.5","173","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C94 H128 N8 O4 Yb4 -","- C94 H128 N8 O4 Yb4 -","- C94 H128 N8 O4 Yb4 -","1","0.5","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.71073","Synchrotron","","0.0362","0.0342","","","0.0725","0.0735","","","","","","1.121","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078202","15.6071","0.0003","14.4245","0.0003","19.1631","0.0004","90","","109.035","0.001","90","","4078.19","0.15","123","1","123","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C88 H130 La2 N8 O4 -","- C88 H130 La2 N8 O4 -","- C176 H260 La4 N16 O8 -","2","0.5","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.71073","MoKα","","0.0519","0.04","","","0.0934","0.1001","","","","","","1.027","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078203","10.0771","0.0005","16.5047","0.0009","15.2788","0.0008","90","","96.256","0.001","90","","2526","0.2","123","1","123","1","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C54 H73 K3 N4 O -","- C54 H74 K3 N4 O -","- C108 H148 K6 N8 O2 -","2","0.5","","Deacon, Glen B.; Gardiner, Michael G.; Junk, Peter C.; Townley, Josh P.; Wang, Jun","Rare-Earth Metalation of Calix[4]pyrrole/Calix[4]arene Free of Alkali-Metal Companions","Organometallics","2012","31","10","3857","","10.1021/om2011134","","","0.71073","MoKα","","0.056","0.0452","","","0.1124","0.1203","","","","","","1.048","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078204","7.7966","0.0004","31.8493","0.0015","11.5616","0.0005","90","","90","","90","","2870.9","0.2","155","2","155","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C28 H24 Fe4 O6 P2 -","- C28 H24 Fe4 O6 P2 -","- C112 H96 Fe16 O24 P8 -","4","1","","Gimbert-Suriñach, Carolina; Bhadbhade, Mohan; Colbran, Stephen B.","Bridgehead Hydrogen Atoms Are Important: Unusual Electrochemistry and Proton Reduction at Iron Dimers with Ferrocenyl-Substituted Phosphido Bridges","Organometallics","2012","31","9","3480","","10.1021/om201126w","","","0.71073","MoKα","","0.0734","0.043","","","0.0716","0.0808","","","","","","1.059","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078205","10.7691","0.0014","23.718","0.003","12.0221","0.0014","90","","106.688","0.012","90","","2941.4","0.7","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 F12 N5 P2 Ru -","- C24 H27 F12 N5 P2 Ru -","- C96 H108 F48 N20 P8 Ru4 -","4","1","","Betanzos-Lara, Soledad; Salassa, Luca; Habtemariam, Abraha; Novakova, Olga; Pizarro, Ana M.; Clarkson, Guy J.; Liskova, Barbora; Brabec, Viktor; Sadler, Peter J.","Photoactivatable Organometallic Pyridyl Ruthenium(II) Arene Complexes","Organometallics","2012","31","9","3466","","10.1021/om201177y","","","0.71073","MoKα","","0.0716","0.0446","","","0.0988","0.1101","","","","","","1.051","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078206","37.0577","0.0009","8.6964","0.0002","20.0783","0.0005","90","","95.974","0.002","90","","6435.5","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H27 F12 N5 P2 Ru -","- C30 H27 F12 N5 P2 Ru -","- C240 H216 F96 N40 P16 Ru8 -","8","1","","Betanzos-Lara, Soledad; Salassa, Luca; Habtemariam, Abraha; Novakova, Olga; Pizarro, Ana M.; Clarkson, Guy J.; Liskova, Barbora; Brabec, Viktor; Sadler, Peter J.","Photoactivatable Organometallic Pyridyl Ruthenium(II) Arene Complexes","Organometallics","2012","31","9","3466","","10.1021/om201177y","","","0.71073","MoKα","","0.0512","0.0349","","","0.0847","0.0877","","","","","","0.984","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078207","15.5359","0.0002","11.15838","0.00017","16.4506","0.0002","90","","96.4121","0.0013","90","","2833.96","0.07","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 F12 N7 O P2 Ru -","- C21 H23 F12 N7 O P2 Ru -","- C84 H92 F48 N28 O4 P8 Ru4 -","4","1","","Betanzos-Lara, Soledad; Salassa, Luca; Habtemariam, Abraha; Novakova, Olga; Pizarro, Ana M.; Clarkson, Guy J.; Liskova, Barbora; Brabec, Viktor; Sadler, Peter J.","Photoactivatable Organometallic Pyridyl Ruthenium(II) Arene Complexes","Organometallics","2012","31","9","3466","","10.1021/om201177y","","","0.71073","MoKα","","0.0396","0.0307","","","0.0805","0.0829","","","","","","1.062","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078208","11.90151","0.00012","18.89949","0.00016","16.67645","0.00019","90","","103.105","0.001","90","","3653.38","0.07","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H39 F12 N3 O2 P2 Ru -","- C33 H39 F12 N3 O2 P2 Ru -","- C132 H156 F48 N12 O8 P8 Ru4 -","4","1","","Betanzos-Lara, Soledad; Salassa, Luca; Habtemariam, Abraha; Novakova, Olga; Pizarro, Ana M.; Clarkson, Guy J.; Liskova, Barbora; Brabec, Viktor; Sadler, Peter J.","Photoactivatable Organometallic Pyridyl Ruthenium(II) Arene Complexes","Organometallics","2012","31","9","3466","","10.1021/om201177y","","","0.71073","MoKα","","0.0425","0.0309","","","0.0769","0.0792","","","","","","1.075","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078209","11.3406","0.0002","19.5778","0.0003","12.3483","0.0003","90","","107.067","0.0019","90","","2620.88","0.09","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 F12 N3 P2 Ru -","- C24 H23 F12 N3 P2 Ru -","- C96 H92 F48 N12 P8 Ru4 -","4","1","","Betanzos-Lara, Soledad; Salassa, Luca; Habtemariam, Abraha; Novakova, Olga; Pizarro, Ana M.; Clarkson, Guy J.; Liskova, Barbora; Brabec, Viktor; Sadler, Peter J.","Photoactivatable Organometallic Pyridyl Ruthenium(II) Arene Complexes","Organometallics","2012","31","9","3466","","10.1021/om201177y","","","0.71073","MoKα","","0.0356","0.0283","","","0.0716","0.0732","","","","","","1.065","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078210","16.333","0.006","17.115","0.007","16.18","0.006","90","","95.05","0.005","90","","4505","3","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H40 Ag Br N12 O -","- C50 H40 Ag Br N12 O -","- C200 H160 Ag4 Br4 N48 O4 -","4","0.5","","Cui, Fengjuan; Yang, Peiju; Huang, Xiaojuan; Yang, Xiao-Juan; Wu, Biao","Homometallic Silver(I) Complexes of a Heterotopic NHC-Bridged Bis-Bipyridine Ligand","Organometallics","2012","31","9","3512","","10.1021/om201226s","","","0.71073","MoKα","","0.0789","0.0692","","","0.2424","0.2536","","","","","","1.096","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078211","12.898","0.003","8.587","0.002","24.578","0.005","90","","109.296","0.01","90","","2569.2","1","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H40 Ag2 F12 N12 P2 -","- C50 H40 Ag2 F12 N12 P2 -","- C100 H80 Ag4 F24 N24 P4 -","2","0.5","","Cui, Fengjuan; Yang, Peiju; Huang, Xiaojuan; Yang, Xiao-Juan; Wu, Biao","Homometallic Silver(I) Complexes of a Heterotopic NHC-Bridged Bis-Bipyridine Ligand","Organometallics","2012","31","9","3512","","10.1021/om201226s","","","0.71073","MoKα","","0.0981","0.0892","","","0.2263","0.2306","","","","","","1.158","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078212","13.104","0.004","20.995","0.007","31.011","0.01","90","","91.163","0.005","90","","8530","5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C200 H160 Ag4 B4 N26 O -","- C200 H160 Ag4 B4 N26 O -","- C400 H320 Ag8 B8 N52 O2 -","2","0.5","","Cui, Fengjuan; Yang, Peiju; Huang, Xiaojuan; Yang, Xiao-Juan; Wu, Biao","Homometallic Silver(I) Complexes of a Heterotopic NHC-Bridged Bis-Bipyridine Ligand","Organometallics","2012","31","9","3512","","10.1021/om201226s","","","0.71073","MoKα","","0.1619","0.0892","","","0.205","0.2311","","","","","","1.054","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078213","11.265","0.002","11.398","0.002","13.912","0.003","107.576","0.002","95.772","0.002","105.009","0.002","1613.5","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H52 Ag3 F18 N16 P3 -","- C58 H52 Ag3 F18 N16 P3 -","- C58 H52 Ag3 F18 N16 P3 -","1","0.5","","Cui, Fengjuan; Yang, Peiju; Huang, Xiaojuan; Yang, Xiao-Juan; Wu, Biao","Homometallic Silver(I) Complexes of a Heterotopic NHC-Bridged Bis-Bipyridine Ligand","Organometallics","2012","31","9","3512","","10.1021/om201226s","","","0.71073","MoKα","","0.0757","0.0617","","","0.1873","0.201","","","","","","1.012","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078214","34.156","0.007","10.371","0.002","27.318","0.006","90","","98.05","0.03","90","","9582","3","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C83 H82 F3 N6 O13 Ru4 S -","- C83 H82 F3 N6 O13 Ru4 S -","- C332 H328 F12 N24 O52 Ru16 S4 -","4","1","","Mishra, Anurag; Jung, Hyunji; Park, Jeong Woo; Kim, Hong Kyeung; Kim, Hyunuk; Stang, Peter J.; Chi, Ki-Whan","Anticancer Activity of Self-Assembled Molecular Rectangles via Arene-Ruthenium Acceptors and a New Unsymmetrical Amide Ligand.","Organometallics","2012","31","9","3519","3526","10.1021/om2012826","","","1","synchrotron","","0.1148","0.0946","","","0.269","0.2883","","","","","","1.19","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078215","15.2967","0.0007","12.8601","0.0006","15.8369","0.0008","90","","102.191","0.003","90","","3045.1","0.3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 N2 Pt Si -","- C14 H20 N2 Pt Si -","- C112 H160 N16 Pt8 Si8 -","8","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0657","0.0469","","","0.1124","0.123","","","","","","1.003","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078216","14.36","0.003","15.182","0.003","17.02","0.003","90","","111.19","0.03","90","","3459.7","1.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13.1 H14 Br2.9 N2 Pt Si -","- C13.1 H14 Br2.9 N2 Pt Si -","- C104.8 H112 Br23.2 N16 Pt8 Si8 -","8","2","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.1249","0.0743","","","0.1957","0.2207","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078217","9.3692","0.0003","13.796","0.0005","14.4724","0.0005","90","","100.964","0.002","90","","1836.52","0.11","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 I2 N2 Pt Si -","- C14 H20 I2 N2 Pt Si -","- C56 H80 I8 N8 Pt4 Si4 -","4","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0594","0.0507","","","0.1369","0.1429","","","","","","1.065","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078218","8.1838","0.0016","8.3091","0.0017","13.131","0.003","79.72","0.03","89.37","0.03","60.64","0.03","762.7","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H19 I N2 Pt -","- C13 H19 I N2 Pt -","- C26 H38 I2 N4 Pt2 -","2","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0774","0.0502","","","0.1047","0.1164","","","","","","1.089","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078219","9.4577","0.0003","11.2012","0.0004","11.2937","0.0004","80.136","0.002","70.691","0.002","82.773","0.002","1109.35","0.07","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C16 H25 F3 N2 O4 Pt S Si -","- C16 H25 F3 N2 O4 Pt S Si -","- C32 H50 F6 N4 O8 Pt2 S2 Si2 -","2","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0271","0.0195","","","0.0344","0.036","","","","","","1.042","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078220","13.855","0.003","14.006","0.003","15.074","0.003","90","","90","","90","","2925.2","1.1","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H14 Cl2 N2 Pt Si -","- C12 H14 Cl2 N2 Pt Si -","- C96 H112 Cl16 N16 Pt8 Si8 -","8","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0994","0.0631","","","0.1583","0.1823","","","","","","1.079","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078221","11.812","0.002","13.535","0.003","16.7","0.003","79.94","0.03","80.78","0.03","79.76","0.03","2563.9","0.9","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C47 H39 B F18 N4 O2 Pt2 Si2 -","- C47 H39 B F18 N4 O2 Pt2 Si2 -","- C94 H78 B2 F36 N8 O4 Pt4 Si4 -","2","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0673","0.0437","","","0.0972","0.1062","","","","","","1.05","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078222","14.305","0.003","10.13","0.002","14.985","0.003","90","","99.04","0.03","90","","2144.5","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 N2 O3 Pt Si -","- C21 H26 N2 O3 Pt Si -","- C84 H104 N8 O12 Pt4 Si4 -","4","1","","Safa, Muhieddine; Jennings, Michael C.; Puddephatt, Richard J.","Reactivity of a Dimethylplatinum(II) Complex with the Bis(2-pyridyl)dimethylsilane Ligand: Easy Silicon‒Carbon Bond Activation","Organometallics","2012","31","9","3539","","10.1021/om3000136","","","0.71073","MoKα","","0.0366","0.0298","","","0.0732","0.0824","","","","","","1.071","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078223","15.042","0.003","10.687","0.002","16.519","0.003","90","","115.76","0.03","90","","2391.6","1","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C53 H67 O3 P2 Ru -","- C53 H67 O3 P2 Ru -","- C106 H134 O6 P4 Ru2 -","2","1","","Vaquero, Mónica; Vargas, Sergio; Suárez, Andrés; Garc\?ía-Garrido, Sergio E.; Álvarez, Eleuterio; Mancera, Manuel; Pizzano, Antonio","Synthesis, Characterization, and Reactivity of Ruthenium Bis-Allyl Complexes with Chiral Phosphine-Phosphite Ligands","Organometallics","2012","31","9","3551","","10.1021/om300018s","","","0.71073","MoKα","","0.0496","0.0443","","","0.1109","0.1151","","","","","","1.038","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078224","14.2819","0.0003","9.155","0.0002","28.3217","0.0005","90","","99.992","0.001","90","","3646.92","0.13","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C78 H110 O6 P4 Ru2 -","- C78 H110 O6 P4 Ru2 -","- C156 H220 O12 P8 Ru4 -","2","1","","Vaquero, Mónica; Vargas, Sergio; Suárez, Andrés; Garc\?ía-Garrido, Sergio E.; Álvarez, Eleuterio; Mancera, Manuel; Pizzano, Antonio","Synthesis, Characterization, and Reactivity of Ruthenium Bis-Allyl Complexes with Chiral Phosphine-Phosphite Ligands","Organometallics","2012","31","9","3551","","10.1021/om300018s","","","0.71073","MoKα","","0.0278","0.0265","","","0.0636","0.0642","","","","","","1.09","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078225","12.9499","0.0002","32.0139","0.0006","13.2115","0.0002","90","","96.143","0.001","90","","5445.73","0.16","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C224 H230 Cl20 O17 P8 Ru4 -","- C224 H230 Cl20 O17 P8 Ru4 -","- C224 H230 Cl20 O17 P8 Ru4 -","1","0.25","","Vaquero, Mónica; Vargas, Sergio; Suárez, Andrés; Garc\?ía-Garrido, Sergio E.; Álvarez, Eleuterio; Mancera, Manuel; Pizzano, Antonio","Synthesis, Characterization, and Reactivity of Ruthenium Bis-Allyl Complexes with Chiral Phosphine-Phosphite Ligands","Organometallics","2012","31","9","3551","","10.1021/om300018s","","","0.71073","MoKα","","0.0556","0.0421","","","0.1082","0.1168","","","","","","1.046","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078226","30.8813","0.0011","11.158","0.0004","22.3386","0.0008","90","","104.853","0.002","90","","7440.1","0.5","103","2","103","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C39 H44 N2 O P2 S Si Sn -","- C39 H44 N2 O P2 S Si Sn -","- C312 H352 N16 O8 P16 S8 Si8 Sn8 -","8","1","","Guo, Jia-Yi; Li, Yongxin; Ganguly, Rakesh; So, Cheuk-Wai","Reactivity of a Tin(II) (Iminophosphinoyl)(thiophosphinoyl)methanediide Complex toward Isocyanates and Rhodium(I) Chloride","Organometallics","2012","31","10","3888","","10.1021/om300062n","","","0.71073","MoKα","","0.0948","0.0612","","","0.1625","0.1916","","","","","","1.351","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078227","11.7899","0.0002","16.7568","0.0003","20.4015","0.0003","90","","97.572","0.001","90","","3995.39","0.12","103","2","103","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C37.5 H47 Cl4 N P2 Rh S Si Sn -","- C37.5 H43 Cl4 N P2 Rh S Si Sn -","- C150 H172 Cl16 N4 P8 Rh4 S4 Si4 Sn4 -","4","1","","Guo, Jia-Yi; Li, Yongxin; Ganguly, Rakesh; So, Cheuk-Wai","Reactivity of a Tin(II) (Iminophosphinoyl)(thiophosphinoyl)methanediide Complex toward Isocyanates and Rhodium(I) Chloride","Organometallics","2012","31","10","3888","","10.1021/om300062n","","","0.71073","MoKα","","0.0412","0.029","","","0.0657","0.0704","","","","","","1.045","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078228","9.4127","0.0003","21.5662","0.0006","19.0244","0.0005","90","","95.348","0.001","90","","3845.07","0.19","103","2","103","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H46 N2 O P2 S Si Sn -","- C41 H46 N2 O P2 S Si Sn -","- C164 H184 N8 O4 P8 S4 Si4 Sn4 -","4","1","","Guo, Jia-Yi; Li, Yongxin; Ganguly, Rakesh; So, Cheuk-Wai","Reactivity of a Tin(II) (Iminophosphinoyl)(thiophosphinoyl)methanediide Complex toward Isocyanates and Rhodium(I) Chloride","Organometallics","2012","31","10","3888","","10.1021/om300062n","","","0.71073","MoKα","","0.0507","0.0333","","","0.0779","0.0928","","","","","","1.082","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078229","20.875","0.005","8.8602","0.0017","5.2408","0.0011","90","","102.626","0.018","90","","945.9","0.4","153","2","153","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C16 H18 B N5 O4 S2 -","- C16 H18 B N5 O4 S2 -","- C32 H36 B2 N10 O8 S4 -","2","0.5","","Filthaus, Matthias; Schwertmann, Larissa; Neuhaus, Patrik; Seidel, Rüdiger W.; Oppel, Iris M.; Bettinger, Holger F.","C‒H Bond Amination by Photochemically Generated Transient Borylnitrenes at Room Temperature: A Combined Experimental and Theoretical Investigation of the Insertion Mechanism and Influence of Substituents","Organometallics","2012","31","10","3894","","10.1021/om300063y","","","0.71073","MoKα","","0.082","0.0641","","","0.1573","0.1649","","","","","","1.054","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078230","6.1606","0.0007","10.5917","0.0013","11.0973","0.0016","80.183","0.017","87.508","0.011","76.776","0.01","694.58","0.16","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H26 B N O2 -","- C13 H26 B N O2 -","- C26 H52 B2 N2 O4 -","2","1","","Filthaus, Matthias; Schwertmann, Larissa; Neuhaus, Patrik; Seidel, Rüdiger W.; Oppel, Iris M.; Bettinger, Holger F.","C–H Bond Amination by Photochemically Generated Transient Borylnitrenes at Room Temperature: A Combined Experimental and Theoretical Investigation of the Insertion Mechanism and Influence of Substituents","Organometallics","2012","31","10","3894","","10.1021/om300063y","","","0.71073","MoKα","","0.1098","0.073","","","0.1998","0.2107","","","","","","1.013","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078231","6.6762","0.0011","9.5002","0.0015","9.5558","0.0017","108.021","0.015","110.272","0.016","91.24","0.013","534.98","0.18","115","2","115","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H8 Cl4 O5 -","- C6 H8 Cl4 O5 -","- C12 H16 Cl8 O10 -","2","1","","Filthaus, Matthias; Schwertmann, Larissa; Neuhaus, Patrik; Seidel, Rüdiger W.; Oppel, Iris M.; Bettinger, Holger F.","C–H Bond Amination by Photochemically Generated Transient Borylnitrenes at Room Temperature: A Combined Experimental and Theoretical Investigation of the Insertion Mechanism and Influence of Substituents","Organometallics","2012","31","10","3894","","10.1021/om300063y","","","0.71073","MoKα","","0.0412","0.0344","","","0.1018","0.1067","","","","","","1.098","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078232","10.1458","0.0009","16.7946","0.0015","17.6451","0.0015","91.249","0.002","93.49","0.002","92.907","0.002","2996.3","0.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H35 F Li O10 P Si2 W -","- C20 H35 F Li O10 P Si2 W -","- C80 H140 F4 Li4 O40 P4 Si8 W4 -","4","2","","Nesterov, Vitaly; Schwieger, Sebastian; Schnakenburg, Gregor; Grimme, Stefan; Streubel, Rainer","SET Oxidation of Li/X Phosphinidenoid Complexes by TEMPO","Organometallics","2012","31","9","3457","","10.1021/om300099g","","","0.71073","MoKα","","0.0526","0.0494","","","0.1329","0.1363","","","","","","1.088","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078233","12.7563","0.0006","20.7282","0.0007","12.9136","0.0006","90","","119.045","0.003","90","","2985.1","0.2","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H38 Li O12 P Si W -","- C21 H38 Li O12 P Si W -","- C84 H152 Li4 O48 P4 Si4 W4 -","4","1","","Nesterov, Vitaly; Schwieger, Sebastian; Schnakenburg, Gregor; Grimme, Stefan; Streubel, Rainer","SET Oxidation of Li/X Phosphinidenoid Complexes by TEMPO","Organometallics","2012","31","9","3457","","10.1021/om300099g","","","0.71073","MoKα","","0.0395","0.0301","","","0.0727","0.0752","","","","","","0.963","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078234","13.5055","0.0006","16.7314","0.0008","17.2324","0.0008","90","","97.638","0.001","90","","3859.4","0.3","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H20 Au Ir4 O11 P -","- C35 H20 Au Ir4 O11 P -","- C140 H80 Au4 Ir16 O44 P4 -","4","1","","Adams, Richard D.; Chen, Mingwei; Yang, Xinzheng","Iridium‒Gold Cluster Compounds: Syntheses, Structures, and an Unusual Ligand-Induced Skeletal Rearrangement","Organometallics","2012","31","9","3588","","10.1021/om3001026","","","0.71073","MoKα","","0.038","0.0297","","","0.0727","0.0778","","","","","","1.002","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078235","10.225","0.0004","15.1704","0.0006","19.2345","0.0007","94.858","0.001","102.439","0.001","98.277","0.001","2862.48","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H42 Au2 Ir4 O10 P2 -","- C58 H42 Au2 Ir4 O10 P2 -","- C116 H84 Au4 Ir8 O20 P4 -","2","1","","Adams, Richard D.; Chen, Mingwei; Yang, Xinzheng","Iridium‒Gold Cluster Compounds: Syntheses, Structures, and an Unusual Ligand-Induced Skeletal Rearrangement","Organometallics","2012","31","9","3588","","10.1021/om3001026","","","0.71073","MoKα","","0.0885","0.0613","","","0.1634","0.1984","","","","","","1.081","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078236","13.3377","0.0003","13.3377","0.0003","48.755","0.002","90","","90","","120","","7511.2","0.4","294","2","294","2","","","","","","","","6","P 65","P 65","170","","","","- C47 H30 Au2 Ir4 O11 P2 -","- C47 H30 Au2 Ir4 O11 P2 -","- C282 H180 Au12 Ir24 O66 P12 -","6","1","","Adams, Richard D.; Chen, Mingwei; Yang, Xinzheng","Iridium‒Gold Cluster Compounds: Syntheses, Structures, and an Unusual Ligand-Induced Skeletal Rearrangement","Organometallics","2012","31","9","3588","","10.1021/om3001026","","","0.71073","MoKα","","0.061","0.0519","","","0.1146","0.1187","","","","","","1.058","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078237","15.858","0.0008","23.855","0.0013","17.3821","0.0009","90","","95.644","0.001","90","","6543.6","0.6","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C65 H46 Au2 Cl2 Ir4 O10 P3 -","- C65 H46 Au2 Cl2 Ir4 O10 P3 -","- C260 H184 Au8 Cl8 Ir16 O40 P12 -","4","1","","Adams, Richard D.; Chen, Mingwei; Yang, Xinzheng","Iridium‒Gold Cluster Compounds: Syntheses, Structures, and an Unusual Ligand-Induced Skeletal Rearrangement","Organometallics","2012","31","9","3588","","10.1021/om3001026","","","0.71073","MoKα","","0.0567","0.0432","","","0.1065","0.1147","","","","","","1.061","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078238","13.7892","0.0014","13.9054","0.0014","17.8443","0.0018","85.321","0.002","75.087","0.002","65.024","0.002","2995.7","0.5","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H42 Au2 Ir4 O9 P3 -","- C60 H42 Au2 Ir4 O9 P3 -","- C120 H84 Au4 Ir8 O18 P6 -","2","1","","Adams, Richard D.; Chen, Mingwei; Yang, Xinzheng","Iridium‒Gold Cluster Compounds: Syntheses, Structures, and an Unusual Ligand-Induced Skeletal Rearrangement","Organometallics","2012","31","9","3588","","10.1021/om3001026","","","0.71073","MoKα","","0.0831","0.058","","","0.128","0.1398","","","","","","1.087","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078239","9.9905","0.001","22.494","0.003","13.6491","0.0015","90","","97.129","0.003","90","","3043.6","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H40 Cl Ir N2 O6 -","- C31 H40 Cl Ir N2 O6 -","- C124 H160 Cl4 Ir4 N8 O24 -","4","1","","Azua, Arturo; Mata, Jose A.; Peris, Eduardo; Lamaty, Frederic; Martinez, Jean; Colacino, Evelina","Alternative Energy Input for Transfer Hydrogenation using Iridium NHC Based Catalysts in Glycerol as Hydrogen Donor and Solvent","Organometallics","2012","31","10","3911","","10.1021/om300109e","","","0.71073","MOKα","","0.114","0.0574","","","0.1275","0.157","","","","","","1.053","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078240","23.0092","0.0004","7.85644","0.00012","14.5126","0.0002","90","","104.176","0.0016","90","","2543.56","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl Ir N2 O3 -","- C25 H36 Cl Ir N2 O3 -","- C100 H144 Cl4 Ir4 N8 O12 -","4","1","","Azua, Arturo; Mata, Jose A.; Peris, Eduardo; Lamaty, Frederic; Martinez, Jean; Colacino, Evelina","Alternative Energy Input for Transfer Hydrogenation using Iridium NHC Based Catalysts in Glycerol as Hydrogen Donor and Solvent","Organometallics","2012","31","10","3911","","10.1021/om300109e","","","0.71073","MOKα","","0.0359","0.0268","","","0.0546","0.0592","","","","","","1.047","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078241","7.8446","0.0009","28.21","0.002","8.2365","0.001","90","","114.61","0.014","90","","1657.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C33 H43 Cl2 Ir N2 O6 -","- C33 H43 Cl2 Ir N2 O6 -","- C66 H86 Cl4 Ir2 N4 O12 -","2","0.5","","Azua, Arturo; Mata, Jose A.; Peris, Eduardo; Lamaty, Frederic; Martinez, Jean; Colacino, Evelina","Alternative Energy Input for Transfer Hydrogenation using Iridium NHC Based Catalysts in Glycerol as Hydrogen Donor and Solvent","Organometallics","2012","31","10","3911","","10.1021/om300109e","","","0.71073","MOKα","","0.1048","0.0654","","","0.1155","0.1302","","","","","","1.05","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078242","11.6533","0.0001","19.0689","0.0001","15.6811","0.0001","90","","104.075","0.001","90","","3379.97","0.04","120","2","120","2","","","","","","","synthesis","8","P 1 21 1","P 2yb","4","","","","- C25 H37 Cl3 F6 Ir N4 O5 P -","- C25 H37 Cl3 F6 Ir N4 O5 P -","- C100 H148 Cl12 F24 Ir4 N16 O20 P4 -","4","2","","Paredes, Paloma; Vega, Esmeralda; Díez, Josefina; Gamasa, M. Pilar","Multiple Carbon‒Carbon and Carbon‒Metal Bond Formation from an Iridium-pybox Complex and Electron-Poor Terminal Alkynes: Synthesis of Iridium Complexes with a Novel κ4N,N,N,C Tetradentate Ligand","Organometallics","2012","31","9","3798","","10.1021/om3001108","","","1.54184","CuKα","","0.0284","0.0259","","","0.0642","0.07","","","","","","1.079","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078243","18.741","0.002","11.1949","0.0012","32.174","0.003","90","","101.875","0.001","90","","6605.8","1.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H53 Cl Ni P2 Si -","- C30 H53 Cl Ni P2 Si -","- C240 H424 Cl8 Ni8 P16 Si8 -","8","1","","Beck, Robert; Johnson, Samuel A.","Structural Similarities in Dinuclear, Tetranuclear, and Pentanuclear Nickel Silyl and Silylene Complexes Obtained via Si‒H and Si‒C Activation","Organometallics","2012","31","9","3599","","10.1021/om300120x","","","0.71073","MoKα","","0.0633","0.0498","","","0.0998","0.108","","","","","","1.093","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078244","11.713","0.002","17.723","0.004","10.674","0.002","90","","108.04","0.03","90","","2106.9","0.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H64 Ni2 P2 Si2 -","- C42 H64 Ni2 P2 Si2 -","- C84 H128 Ni4 P4 Si4 -","2","0.5","","Beck, Robert; Johnson, Samuel A.","Structural Similarities in Dinuclear, Tetranuclear, and Pentanuclear Nickel Silyl and Silylene Complexes Obtained via Si‒H and Si‒C Activation","Organometallics","2012","31","9","3599","","10.1021/om300120x","","","0.71073","MoKα","","0.033","0.0295","","","0.0738","0.077","","","","","","1.05","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078245","29.199","0.003","29.199","0.003","29.199","0.003","90","","90","","90","","24895","4","173","2","173","2","","","","","","","","5","I -4 3 d","I -4bd 2c 3","220","","","","- C54 H102 Ni4 P4 Si3 -","- C54 H102 Ni4 P4 Si3 -","- C864 H1632 Ni64 P64 Si48 -","16","0.333333","","Beck, Robert; Johnson, Samuel A.","Structural Similarities in Dinuclear, Tetranuclear, and Pentanuclear Nickel Silyl and Silylene Complexes Obtained via Si‒H and Si‒C Activation","Organometallics","2012","31","9","3599","","10.1021/om300120x","","","0.71073","MoKα","","0.0349","0.0316","","","0.0778","0.0822","","","","","","1.087","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078246","15.1577","0.0012","15.1577","0.0012","14.868","0.002","90","","90","","90","","3416","0.6","173","2","173","2","","","","","","","","5","I -4","I -4","82","","","","- C60 H108 Ni5 P4 Si4 -","- C60 H107.591 Ni5 P4 Si4 -","- C120 H215.182 Ni10 P8 Si8 -","2","0.25","","Beck, Robert; Johnson, Samuel A.","Structural Similarities in Dinuclear, Tetranuclear, and Pentanuclear Nickel Silyl and Silylene Complexes Obtained via Si‒H and Si‒C Activation","Organometallics","2012","31","9","3599","","10.1021/om300120x","","","0.71073","MoKα","","0.029","0.0275","","","0.0668","0.0685","","","","","","1.071","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078247","15.2973","0.0018","15.2853","0.0018","17.426","0.002","90","","117.461","0.001","90","","3615.5","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H58 Ni2 P2 Si -","- C36 H58 Ni2 P2 Si -","- C144 H232 Ni8 P8 Si4 -","4","1","","Beck, Robert; Johnson, Samuel A.","Structural Similarities in Dinuclear, Tetranuclear, and Pentanuclear Nickel Silyl and Silylene Complexes Obtained via Si‒H and Si‒C Activation","Organometallics","2012","31","9","3599","","10.1021/om300120x","","","0.71073","MoKα","","0.1096","0.0665","","","0.1241","0.1406","","","","","","1.04","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078248","9.9086","0.0011","9.2532","0.001","22.278","0.002","90","","95.895","0.002","90","","2031.8","0.4","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","Ir(TTP)(CO)NCS (Compound #6)","","","- C50 H36 Ir N5 O S -","- C50 H36 Ir N5 O S -","- C100 H72 Ir2 N10 O2 S2 -","2","1","","Anding, Bernie J.; Ellern, Arkady; Woo, L. Keith","Olefin Cyclopropanation Catalyzed by Iridium(III) Porphyrin Complexes","Organometallics","2012","31","9","3628","","10.1021/om300135f","","","0.71073","MoKα","","0.0829","0.0773","","","0.164","0.1686","","","","","","1.133","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078249","14.643","0.0007","14.643","0.0007","9.6955","0.0005","90","","90","","90","","2078.88","0.18","173","2","173","2","","","","","","","","6","I 4/m","-I 4","87","Ir(TTP)(CO)Br (Compound #4)","","","- C49 H36 Br Ir N4 O -","- C49 H36 Br Ir N4 O -","- C98 H72 Br2 Ir2 N8 O2 -","2","0.125","","Anding, Bernie J.; Ellern, Arkady; Woo, L. Keith","Olefin Cyclopropanation Catalyzed by Iridium(III) Porphyrin Complexes","Organometallics","2012","31","9","3628","","10.1021/om300135f","","","0.71073","MoKα","","0.0282","0.0282","","","0.076","0.076","","","","","","1.154","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078250","14.6955","0.0005","14.6955","0.0005","9.7922","0.0004","90","","90","","90","","2114.7","0.13","173","2","173","2","","","","","","","","6","I 4/m","-I 4","87","Ir(TTP)(CO)I (Compound","","","- C49 H36 I Ir N4 O -","- C49 H36 I Ir N4 O -","- C98 H72 I2 Ir2 N8 O2 -","2","0.125","","Anding, Bernie J.; Ellern, Arkady; Woo, L. Keith","Olefin Cyclopropanation Catalyzed by Iridium(III) Porphyrin Complexes","Organometallics","2012","31","9","3628","","10.1021/om300135f","","","0.71073","MoKα","","0.0477","0.0471","","","0.1362","0.1366","","","","","","1.346","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078251","13.0353","0.0011","15.4171","0.0013","24.578","0.002","90","","102.061","0.001","90","","4830.3","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ir(TTP)(NMe3)Cl (Compound #3)","","","- C53 H49 Cl5 Ir N5 -","- C53 H49 Cl5 Ir N5 -","- C212 H196 Cl20 Ir4 N20 -","4","1","","Anding, Bernie J.; Ellern, Arkady; Woo, L. Keith","Olefin Cyclopropanation Catalyzed by Iridium(III) Porphyrin Complexes","Organometallics","2012","31","9","3628","","10.1021/om300135f","","","0.71073","MoKα","","0.0303","0.024","","","0.0606","0.0645","","","","","","1.08","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078252","16.5418","0.0012","8.6422","0.0006","18.1648","0.0014","90","","91.901","0.004","90","","2595.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Cl4 N4 O2 Ru2 -","- C52 H62 Cl4 N4 O2 Ru2 -","- C104 H124 Cl8 N8 O4 Ru4 -","2","0.5","","Grudzień, Krzysztof; Malinska, Maura; Barbasiewicz, Michał","Synthesis and Properties of Bimetallic Hoveyda‒Grubbs Metathesis Catalysts","Organometallics","2012","31","9","3636","","10.1021/om3001372","","","0.71073","MoKα","","0.0377","0.0302","","","0.0813","0.092","","","","","","1.116","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078253","36.8474","0.001","70.458","0.002","11.8778","0.0004","90","","90","","90","","30837.1","1.6","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C38 H46 Cl2 N2 O2 Ru -","- C38 H46 Cl2 N2 O2 Ru -","- C1216 H1472 Cl64 N64 O64 Ru32 -","32","2","","Grudzień, Krzysztof; Malinska, Maura; Barbasiewicz, Michał","Synthesis and Properties of Bimetallic Hoveyda‒Grubbs Metathesis Catalysts","Organometallics","2012","31","9","3636","","10.1021/om3001372","","","0.71073","MoKα","","0.0388","0.0343","","","0.0793","0.0814","","","","","","1.047","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078254","12.507","0.003","10.265","0.002","14","0.003","90","","102.64","0.03","90","","1753.8","0.7","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Compound 2","","","- C9 H29 Cl Ir P3 -","- C9 H29 Cl Ir P3 -","- C36 H116 Cl4 Ir4 P12 -","4","1","","Merola, Joseph S.; Husebo, Trang Le; Matthews, Kelly E.","Aqueous Organometallic Chemistry ofmer-Ir(H)2(PMe3)3X Complexes","Organometallics","2012","31","10","3920","","10.1021/om300140f","","","0.71073","MoKα","","0.0473","0.0387","","","0.0953","0.1005","","","","","","1.04","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078255","11.827","0.003","12.535","0.003","14.506","0.003","90","","90","","90","","2150.5","0.9","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Compopund 4d","","","- C15 H35 Cl Ir P3 -","- C15 H35 Cl Ir P3 -","- C60 H140 Cl4 Ir4 P12 -","4","1","","Merola, Joseph S.; Husebo, Trang Le; Matthews, Kelly E.","Aqueous Organometallic Chemistry ofmer-Ir(H)2(PMe3)3X Complexes","Organometallics","2012","31","10","3920","","10.1021/om300140f","","","0.71073","MoKα","","0.0364","0.0292","","","0.0647","0.0674","","","","","","1.039","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078256","8.489","0.007","11.995","0.005","14.916","0.007","84.08","0.04","76.51","0.05","71.39","0.05","1399","1.5","298","","298","","","","","","","","","5","P -1","-P 1","2","Compound 9","","","- C22 H44 Ir O2 P3 -","- C22 H43 Ir O2 P3 -","- C44 H86 Ir2 O4 P6 -","2","1","","Merola, Joseph S.; Husebo, Trang Le; Matthews, Kelly E.","Aqueous Organometallic Chemistry ofmer-Ir(H)2(PMe3)3X Complexes","Organometallics","2012","31","10","3920","","10.1021/om300140f","","","0.71073","MoKα","","0.0842","0.0495","","","0.0882","0.0994","","","","","","1.005","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078257","7.2906","0.0004","16.5411","0.0009","17.4266","0.0015","90","","98.898","0.002","90","","2076.3","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 F3 N3 O6 Pd S -","- C15 H18 F3 N3 O6 Pd S -","- C60 H72 F12 N12 O24 Pd4 S4 -","4","1","","Oliva-Madrid, María-José; Garc\?ía-López, José-Antonio; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Ortho Palladation of the Phenethylamines of Biological Relevancel-Tyrosine Methyl Ester and Homoveratrylamine. Reactivity of the Palladacycles toward CO and Isocyanides. Synthesis of the Natural Alkaloid Corydaldine","Organometallics","2012","31","9","3647","","10.1021/om300141b","","","0.71073","MoKα","","0.0713","0.0556","","","0.1066","0.1122","","","","","","1.129","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078258","10.1867","0.0005","12.514","0.006","13.6052","0.0007","66.454","0.002","79.382","0.002","77.703","0.002","1543.9","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H30 N O5 P Pd -","- C30 H30 N O5 P Pd -","- C60 H60 N2 O10 P2 Pd2 -","2","1","","Oliva-Madrid, María-José; Garc\?ía-López, José-Antonio; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Ortho Palladation of the Phenethylamines of Biological Relevancel-Tyrosine Methyl Ester and Homoveratrylamine. Reactivity of the Palladacycles toward CO and Isocyanides. Synthesis of the Natural Alkaloid Corydaldine","Organometallics","2012","31","9","3647","","10.1021/om300141b","","","0.71073","MoKα","","0.0437","0.0377","","","0.0927","0.095","","","","","","1.052","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078259","8.334","0.0008","8.4418","0.0008","17.1024","0.0017","93.04","0.002","100.487","0.002","93.215","0.002","1178.8","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H30 Br2 N2 O4 Pd -","- C20 H30 Br2 N2 O4 Pd -","- C40 H60 Br4 N4 O8 Pd2 -","2","1","","Oliva-Madrid, María-José; Garc\?ía-López, José-Antonio; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Ortho Palladation of the Phenethylamines of Biological Relevancel-Tyrosine Methyl Ester and Homoveratrylamine. Reactivity of the Palladacycles toward CO and Isocyanides. Synthesis of the Natural Alkaloid Corydaldine","Organometallics","2012","31","9","3647","","10.1021/om300141b","","","0.71073","MoKα","","0.0361","0.0328","","","0.069","0.0704","","","","","","1.12","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078260","16.5114","0.0007","5.3548","0.0002","16.3972","0.0007","90","","109.139","0.002","90","","1369.63","0.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 N2 O10 Pd -","- C24 H40 N2 O10 Pd -","- C48 H80 N4 O20 Pd2 -","2","0.5","","Oliva-Madrid, María-José; Garc\?ía-López, José-Antonio; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Ortho Palladation of the Phenethylamines of Biological Relevancel-Tyrosine Methyl Ester and Homoveratrylamine. Reactivity of the Palladacycles toward CO and Isocyanides. Synthesis of the Natural Alkaloid Corydaldine","Organometallics","2012","31","9","3647","","10.1021/om300141b","","","0.71073","MoKα","","0.0327","0.0301","","","0.0657","0.0671","","","","","","1.117","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078261","10.7469","0.0009","12.5246","0.0011","12.5931","0.0011","79.641","0.002","82.117","0.002","81.423","0.002","1638.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H36 N O6 P Pd -","- C32 H36 N O6 P Pd -","- C64 H72 N2 O12 P2 Pd2 -","2","1","","Oliva-Madrid, María-José; Garc\?ía-López, José-Antonio; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Ortho Palladation of the Phenethylamines of Biological Relevancel-Tyrosine Methyl Ester and Homoveratrylamine. Reactivity of the Palladacycles toward CO and Isocyanides. Synthesis of the Natural Alkaloid Corydaldine","Organometallics","2012","31","9","3647","","10.1021/om300141b","","","0.71073","MoKα","","0.0274","0.0257","","","0.0621","0.0629","","","","","","1.049","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078262","15.064","0.003","13.146","0.002","20.481","0.003","90","","92.762","0.002","90","","4051.2","1.2","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H3 Au F15 N -","- C20 H3 Au F15 N -","- C160 H24 Au8 F120 N8 -","8","1","","Overton, Atiya T.; López-de-Luzuriaga, José M.; Olmos, M. Elena; Mohamed, Ahmed A.","Oxidative Rearrangement in Gold Organometallics","Organometallics","2012","31","9","3460","","10.1021/om3001422","","","0.71073","MoKα","","0.035","0.0269","","","0.0612","0.0643","","","","","","1.069","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078263","14.824","0.009","12.977","0.008","27.363","0.016","90","","90","","90","","5264","5","110","2","110","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C16 H6 Au Cl10 F6 N2 P -","- C16 H6 Au Cl10 F6 N2 P -","- C128 H48 Au8 Cl80 F48 N16 P8 -","8","1","","Overton, Atiya T.; López-de-Luzuriaga, José M.; Olmos, M. Elena; Mohamed, Ahmed A.","Oxidative Rearrangement in Gold Organometallics","Organometallics","2012","31","9","3460","","10.1021/om3001422","","","0.71073","MoKα","","0.1509","0.0853","","","0.1516","0.1749","","","","","","1.046","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078264","9.7921","0.0011","11.9791","0.0013","14.8214","0.0016","111.514","0.002","95.467","0.003","109.355","0.002","1478.7","0.3","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H18 Cl N4 O3 Re S8 -","- C21 H18 Cl N4 O3 Re S8 -","- C42 H36 Cl2 N8 O6 Re2 S16 -","2","1","","Xiong, Jing; Liu, Wei; Wang, Yong; Cui, Long; Li, Yi-Zhi; Zuo, Jing-Lin","Tricarbonyl Mono- and Dinuclear Rhenium(I) Complexes with Redox-Active Bis(pyrazole)‒Tetrathiafulvalene Ligands: Syntheses, Crystal Structures, and Properties","Organometallics","2012","31","10","3938","","10.1021/om300159r","","","0.71073","MoKα","","0.0499","0.0429","","","0.0967","0.0983","","","","","","1.005","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078265","11.2192","0.0011","11.7727","0.0014","32.7018","0.0018","85.256","0.002","88.35","0.003","67.472","0.002","3976","0.7","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C90 H84 Cl22 N16 O15 Re4 S32 -","- C90 H84 Cl22 N16 O15 Re4 S32 -","- C90 H84 Cl22 N16 O15 Re4 S32 -","1","0.5","","Xiong, Jing; Liu, Wei; Wang, Yong; Cui, Long; Li, Yi-Zhi; Zuo, Jing-Lin","Tricarbonyl Mono- and Dinuclear Rhenium(I) Complexes with Redox-Active Bis(pyrazole)–Tetrathiafulvalene Ligands: Syntheses, Crystal Structures, and Properties","Organometallics","2012","31","10","3938","","10.1021/om300159r","","","0.71073","MoKα","","0.0673","0.0487","","","0.1135","0.1231","","","","","","1.164","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078266","10.382","0.002","27.9179","0.0014","13.2827","0.0016","90","","113.004","0.003","90","","3543.8","0.8","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H56 Cl2 N8 O8 Re2 S16 -","- C50 H56 Cl2 N8 O8 Re2 S16 -","- C100 H112 Cl4 N16 O16 Re4 S32 -","2","0.5","","Xiong, Jing; Liu, Wei; Wang, Yong; Cui, Long; Li, Yi-Zhi; Zuo, Jing-Lin","Tricarbonyl Mono- and Dinuclear Rhenium(I) Complexes with Redox-Active Bis(pyrazole)‒Tetrathiafulvalene Ligands: Syntheses, Crystal Structures, and Properties","Organometallics","2012","31","10","3938","","10.1021/om300159r","","","0.71073","MoKα","","0.0715","0.0477","","","0.114","0.125","","","","","","1.051","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078267","10.9905","0.0008","14.5602","0.0011","18.7056","0.0015","90","","90","","90","","2993.3","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H32 Cl Co N4 -","- C32 H32 Cl Co N4 -","- C128 H128 Cl4 Co4 N16 -","4","1","","Zhu, Di; Korobkov, Ilia; Budzelaar, Peter H. M.","Radical Mechanisms in the Reaction of Organic Halides with Diiminepyridine Cobalt Complexes","Organometallics","2012","31","10","3958","","10.1021/om300182c","","x-ray","0.71073","MoKα","","0.0784","0.0523","","","0.13","0.1444","","","","","","0.923","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078268","19.1003","0.0011","30.6877","0.0018","8.3627","0.0005","90","","90","","90","","4901.7","0.5","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","{2,6-[1-(2,6-dimethylphenylimino)ethyl]pyridine}cobalt(I) pi-allyl complex","","- C28 H32 Co N3 -","- C28 H32 Co N3 -","- C224 H256 Co8 N24 -","8","1","","Zhu, Di; Korobkov, Ilia; Budzelaar, Peter H. M.","Radical Mechanisms in the Reaction of Organic Halides with Diiminepyridine Cobalt Complexes","Organometallics","2012","31","10","3958","","10.1021/om300182c","","x-ray","0.71073","MoKα","","0.093","0.0435","","","0.1069","0.1443","","","","","","0.992","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078269","13.586","0.005","16.687","0.007","16.63","0.006","90","","101.567","0.009","90","","3694","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H53 Cl0.06 Co I0.94 N3 -","- C37 H53 Cl0.067 Co I0.933 N3 -","- C148 H212 Cl0.268 Co4 I3.732 N12 -","4","1","","Zhu, Di; Korobkov, Ilia; Budzelaar, Peter H. M.","Radical Mechanisms in the Reaction of Organic Halides with Diiminepyridine Cobalt Complexes","Organometallics","2012","31","10","3958","","10.1021/om300182c","","x-ray","0.71073","MoKα","","0.0494","0.0408","","","0.1263","0.1427","","","","","","1.159","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078270","12.9841","0.0008","16.2444","0.001","18.4949","0.0011","90","","90","","90","","3900.9","0.4","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H53 Co I2 N3 -","- C37 H53 Co I2 N3 -","- C148 H212 Co4 I8 N12 -","4","1","","Zhu, Di; Korobkov, Ilia; Budzelaar, Peter H. M.","Radical Mechanisms in the Reaction of Organic Halides with Diiminepyridine Cobalt Complexes","Organometallics","2012","31","10","3958","","10.1021/om300182c","","","0.71073","MoKα","","0.0445","0.0344","","","0.0914","0.0979","","","","","","1.015","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078271","14.5646","0.0008","20.2322","0.0009","18.8482","0.0012","90","","109.676","0.005","90","","5229.8","0.5","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C98 H102 In4 O12 -","- C98 H100 In4 O12 -","- C196 H200 In8 O24 -","2","0.5","","Ahmad, S. Usman; Beckmann, Jens; Duthie, Andrew","Concomitant Reactivity of them-Terphenylindium Dihydroxide [2,6-Mes2C6H3In(OH)2]4toward Carbon Dioxide and Ethylene Glycol","Organometallics","2012","31","9","3802","","10.1021/om3001857","","","0.71073","MoKα","","0.0667","0.0439","","","0.116","0.1233","","","","","","0.912","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078272","14.936","0.005","28.367","0.01","22.525","0.01","90","","90","","90","","9544","6","150","","150","","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C108 H132 In4 O10 -","- C108 H124 In4 O10 -","- C432 H496 In16 O40 -","4","0.5","","Ahmad, S. Usman; Beckmann, Jens; Duthie, Andrew","Concomitant Reactivity of them-Terphenylindium Dihydroxide [2,6-Mes2C6H3In(OH)2]4toward Carbon Dioxide and Ethylene Glycol","Organometallics","2012","31","9","3802","","10.1021/om3001857","","","0.71073","MoKα","","0.0685","0.0323","","","0.0583","0.0737","","","","","","0.825","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078273","13.372","0.008","19.775","0.015","17.78","0.012","90","","102.4","0.05","90","","4592","5","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C102 H110 In4 O12 -","- C102 H108 In4 O12 -","- C204 H216 In8 O24 -","2","0.5","","Ahmad, S. Usman; Beckmann, Jens; Duthie, Andrew","Concomitant Reactivity of them-Terphenylindium Dihydroxide [2,6-Mes2C6H3In(OH)2]4toward Carbon Dioxide and Ethylene Glycol","Organometallics","2012","31","9","3802","","10.1021/om3001857","","","0.71073","MoKα","","0.1593","0.0557","","","0.0913","0.1228","","","","","","0.691","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078274","19.9603","0.0005","11.7532","0.0002","24.2643","0.0006","90","","101.691","0.002","90","","5574.3","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C62 H74 Cr N4 P4 -","- C62 H74 Cr N4 P4 -","- C248 H296 Cr4 N16 P16 -","4","1","","Müller, Bernd H.; Peulecke, Normen; Spannenberg, Anke; Rosenthal, Uwe; Al-Hazmi, Mohammed H.; Schmidt, Roland; Wöhl, Anina; Müller, Wolfgang","Synthesis and Reactions of the Homoleptic Chromium(II) Bis-amide [Ph2PN(iPr)P(Ph)N(iPr)−]2Cr with Relevance to a Selective Catalytic Ethene Trimerization System to 1-Hexene","Organometallics","2012","31","9","3695","","10.1021/om300186a","","","0.71073","MoKα","","0.0809","0.0444","","","0.0998","0.1069","","","","","","0.832","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078275","10.7903","0.0002","11.4254","0.0002","14.7974","0.0003","90.77","0.001","98.966","0.001","112.352","0.001","1661.31","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H76 Al2 Cl6 Cr2 N4 P4 -","- C59 H76 Al2 Cl6 Cr2 N4 P4 -","- C59 H76 Al2 Cl6 Cr2 N4 P4 -","1","0.5","","Müller, Bernd H.; Peulecke, Normen; Spannenberg, Anke; Rosenthal, Uwe; Al-Hazmi, Mohammed H.; Schmidt, Roland; Wöhl, Anina; Müller, Wolfgang","Synthesis and Reactions of the Homoleptic Chromium(II) Bis-amide [Ph2PN(iPr)P(Ph)N(iPr)−]2Cr with Relevance to a Selective Catalytic Ethene Trimerization System to 1-Hexene","Organometallics","2012","31","9","3695","","10.1021/om300186a","","","0.71073","MoKα","","0.0462","0.0385","","","0.1021","0.1106","","","","","","1.055","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078276","7.7979","0.0013","12.786","0.003","16.615","0.003","90","","90","","90","","1656.6","0.6","203","2","203","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 B N6 O2 Pt -","- C13 H17 B N6 O2 Pt -","- C52 H68 B4 N24 O8 Pt4 -","4","1","","Bette, Martin; Rüffer, Tobias; Bruhn, Clemens; Schmidt, Jürgen; Steinborn, Dirk","Synthesis, Characterization, and Reactivity of Diacetylplatinum(II) and -platinum(IV) Complexes Bearing κ2- and κ3-Coordinated Scorpionate Ligands","Organometallics","2012","31","9","3700","","10.1021/om3001907","","","0.71073","MoKα","","0.0261","0.0242","","","0.0589","0.0601","","","","","","1.048","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078277","9.7936","0.0019","12.8","0.005","15.055","0.004","90","","115.63","0.017","90","","1701.6","0.9","220","2","220","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 B Cl N6 O2 Pt -","- C13 H16 B Cl N6 O2 Pt -","- C52 H64 B4 Cl4 N24 O8 Pt4 -","4","1","","Bette, Martin; Rüffer, Tobias; Bruhn, Clemens; Schmidt, Jürgen; Steinborn, Dirk","Synthesis, Characterization, and Reactivity of Diacetylplatinum(II) and -platinum(IV) Complexes Bearing κ2- and κ3-Coordinated Scorpionate Ligands","Organometallics","2012","31","9","3700","","10.1021/om3001907","","","0.71073","MoKα","","0.0321","0.0228","","","0.0533","0.056","","","","","","1.031","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078278","9.7876","0.0005","16.6534","0.0006","11.7754","0.0006","90","","108.631","0.004","90","","1818.77","0.15","200","2","200","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H42 B K N8 O8 Pt -","- C28 H42 B K N8 O8 Pt -","- C56 H84 B2 K2 N16 O16 Pt2 -","2","1","","Bette, Martin; Rüffer, Tobias; Bruhn, Clemens; Schmidt, Jürgen; Steinborn, Dirk","Synthesis, Characterization, and Reactivity of Diacetylplatinum(II) and -platinum(IV) Complexes Bearing κ2- and κ3-Coordinated Scorpionate Ligands","Organometallics","2012","31","9","3700","","10.1021/om3001907","","","0.71073","MoKα","","0.0316","0.0279","","","0.0677","0.0687","","","","","","0.974","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078279","9.1821","0.0004","9.5744","0.0004","12.9873","0.0004","85.422","0.003","84.808","0.003","64.466","0.004","1024.95","0.08","105","","105","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H23 B N6 O2 Pt -","- C20 H23 B N6 O2 Pt -","- C40 H46 B2 N12 O4 Pt2 -","2","1","","Bette, Martin; Rüffer, Tobias; Bruhn, Clemens; Schmidt, Jürgen; Steinborn, Dirk","Synthesis, Characterization, and Reactivity of Diacetylplatinum(II) and -platinum(IV) Complexes Bearing κ2- and κ3-Coordinated Scorpionate Ligands","Organometallics","2012","31","9","3700","","10.1021/om3001907","","","0.71073","MoKα","","0.0236","0.0187","","","0.042","0.0433","","","","","","1.045","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078280","12.9318","0.0011","14.0685","0.0012","14.8638","0.0013","77.926","0.002","87.072","0.002","67.016","0.002","2433","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24.5 H25.5 Cl3.5 N3 Pd -","- C24.5 H25.5 Cl3.5 N3 Pd -","- C98 H102 Cl14 N12 Pd4 -","4","2","","Mart\?ínez-Mart\?ínez, Antonio-Jesús; Chicote, María-Teresa; Bautista, Delia; Vicente, José","Synthesis of Palladium(II), -(III), and -(IV) Complexes with Acyclic Diaminocarbene Ligands","Organometallics","2012","31","9","3711","","10.1021/om300201s","","","0.71073","MoKα","","0.0807","0.0667","","","0.1131","0.1178","","","","","","1.239","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078281","10.2499","0.0005","14.6931","0.0007","17.9342","0.0009","71.603","0.002","78.117","0.002","74.951","0.002","2452.3","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C47.66 H51.96 Cl0.34 F6 N5 O6.88 Pd S2 -","- C47.652 H51.956 Cl0.348 F6 N5 O6.884 Pd S2 -","- C95.304 H103.912 Cl0.696 F12 N10 O13.768 Pd2 S4 -","2","1","","Mart\?ínez-Mart\?ínez, Antonio-Jesús; Chicote, María-Teresa; Bautista, Delia; Vicente, José","Synthesis of Palladium(II), -(III), and -(IV) Complexes with Acyclic Diaminocarbene Ligands","Organometallics","2012","31","9","3711","","10.1021/om300201s","","","0.71073","MoKα","","0.0427","0.0374","","","0.0856","0.0881","","","","","","1.074","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078282","11.4813","0.0006","11.9026","0.0006","14.9934","0.0008","100.373","0.002","103.83","0.002","94.306","0.002","1942.02","0.18","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C35 H35 Cl3 F3 I N4 O3 Pd S -","- C35 H35 Cl3 F3 I N4 O3 Pd S -","- C70 H70 Cl6 F6 I2 N8 O6 Pd2 S2 -","2","1","","Mart\?ínez-Mart\?ínez, Antonio-Jesús; Chicote, María-Teresa; Bautista, Delia; Vicente, José","Synthesis of Palladium(II), -(III), and -(IV) Complexes with Acyclic Diaminocarbene Ligands","Organometallics","2012","31","9","3711","","10.1021/om300201s","","","0.71073","MoKα","","0.0778","0.0598","","","0.1309","0.1394","","","","","","1.093","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078283","28.9644","0.0002","14.5041","0.0001","26.9041","0.0003","90","","110.843","0.001","90","","10562.8","0.17","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","MM78 (naranja) en C2/c (tol/hex)","","","- C54.5 H25 Au3 Cu F20 N3 -","- C54.5 H25 Au3 Cu F20 N3 -","- C436 H200 Au24 Cu8 F160 N24 -","8","1","","López-de-Luzuriaga, José M.; Monge, Miguel; Olmos, M. Elena; Pascual, David; Rodr\?íguez-Castillo, Mar\?ía","Very Short Metallophilic Interactions Induced by Three-Center‒Two-Electron Perhalophenyl Ligands in Phosphorescent Au‒Cu Complexes","Organometallics","2012","31","9","3720","","10.1021/om300204x","","","0.71073","MoKα","","0.0584","0.0387","","","0.0898","0.098","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078284","12.5473","0.0003","17.8938","0.0009","21.8989","0.0009","90","","119.914","0.003","90","","4261.7","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Compound X","","","- C36 H14 Au2 Cl15 Cu N2 -","- C36 H14 Au2 Cl15 Cu N2 -","- C144 H56 Au8 Cl60 Cu4 N8 -","4","1","","López-de-Luzuriaga, José M.; Monge, Miguel; Olmos, M. Elena; Pascual, David; Rodr\?íguez-Castillo, Mar\?ía","Very Short Metallophilic Interactions Induced by Three-Center‒Two-Electron Perhalophenyl Ligands in Phosphorescent Au‒Cu Complexes","Organometallics","2012","31","9","3720","","10.1021/om300204x","","","0.71073","MoKα","","0.0923","0.0568","","","0.124","0.143","","","","","","1.034","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078285","14.1705","0.0006","12.5822","0.0004","21.6166","0.0008","90","","98.452","0.003","90","","3812.3","0.2","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C38 H44 Cl2 Fe N O5 P Ru -","- C38 H44 Cl2 Fe N O5 P Ru -","- C152 H176 Cl8 Fe4 N4 O20 P4 Ru4 -","4","1","","Tauchman, Jiří; Therrien, Bruno; Süss-Fink, Georg; Štěpnička, Petr","Heterodinuclear Arene Ruthenium Complexes Containing a Glycine-Derived Phosphinoferrocene Carboxamide: Synthesis, Molecular Structure, Electrochemistry, and Catalytic Oxidation Activity in Aqueous Media","Organometallics","2012","31","10","3985","","10.1021/om3002087","","","0.71073","MoKα","","0.1421","0.1136","","","0.1219","0.1299","","","","","","1.354","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078286","10.5046","0.0005","30.0795","0.0012","15.1574","0.0008","90","","98.38","0.004","90","","4738.2","0.4","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40 H44 F12 Fe N3 O3 P3 Ru -","- C40 H44 F12 Fe N3 O3 P3 Ru -","- C160 H176 F48 Fe4 N12 O12 P12 Ru4 -","4","1","","Tauchman, Jiří; Therrien, Bruno; Süss-Fink, Georg; Štěpnička, Petr","Heterodinuclear Arene Ruthenium Complexes Containing a Glycine-Derived Phosphinoferrocene Carboxamide: Synthesis, Molecular Structure, Electrochemistry, and Catalytic Oxidation Activity in Aqueous Media","Organometallics","2012","31","10","3985","","10.1021/om3002087","","","0.71073","MoKα","","0.1903","0.1208","","","0.1782","0.2048","","","","","","1.197","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078287","40.703","0.005","18.366","0.002","13.476","0.0017","90","","109.737","0.003","90","","9482","2","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H67 N4 Sc Si4 -","- C39 H67 N4 Sc Si4 -","- C312 H536 N32 Sc8 Si32 -","8","1","","Chen, Fei; Fan, Shimin; Wang, Yibin; Chen, Jue; Luo, Yunjie","Unusual Si–H Bond Activation and Formation of Cationic Scandium Amide Complexes from a Mono(amidinate)-Ligated Scandium Bis(silylamide) Complex and Their Performance in Isoprene Polymerization","Organometallics","2012","31","9","3730","","10.1021/om3002119","","","0.71075","MoKα","","0.1186","0.0846","","","0.1782","0.196","","","","","","1.141","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078288","12.0543","0.0007","17.8419","0.0011","19.6145","0.0012","83.313","0.005","81.325","0.005","79.149","0.004","4078.8","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C74 H89 B F20 N4 O2 Sc Si4 -","- C74 H70 B F20 N4 O2 Sc Si4 -","- C148 H140 B2 F40 N8 O4 Sc2 Si8 -","2","1","","Chen, Fei; Fan, Shimin; Wang, Yibin; Chen, Jue; Luo, Yunjie","Unusual Si‒H Bond Activation and Formation of Cationic Scandium Amide Complexes from a Mono(amidinate)-Ligated Scandium Bis(silylamide) Complex and Their Performance in Isoprene Polymerization","Organometallics","2012","31","9","3730","","10.1021/om3002119","","","0.7107","MoKα","","0.1115","0.0878","","","0.2143","0.2318","","","","","","1.125","","","","has coordinates,has disorder","178671","2020-10-21","18:00:00",""
"4078289","17.497","0.006","13.674","0.004","17.26","0.006","90","","93.728","0.008","90","","4121","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H63 Al2 N2 Sc -","- C39 H63 Al2 N2 Sc -","- C156 H252 Al8 N8 Sc4 -","4","0.5","","Chen, Fei; Fan, Shimin; Wang, Yibin; Chen, Jue; Luo, Yunjie","Unusual Si‒H Bond Activation and Formation of Cationic Scandium Amide Complexes from a Mono(amidinate)-Ligated Scandium Bis(silylamide) Complex and Their Performance in Isoprene Polymerization","Organometallics","2012","31","9","3730","","10.1021/om3002119","","","0.7107","MoKα","","0.1021","0.0935","","","0.2251","0.2307","","","","","","1.147","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078290","8.6119","0.0006","8.7766","0.0006","14.8426","0.0012","82.108","0.002","78.096","0.002","78.395","0.002","1069.9","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H23 Cl N2 O7 Pd -","- C20 H23 Cl N2 O7 Pd -","- C40 H46 Cl2 N4 O14 Pd2 -","2","1","","Juliá-Hernández, Francisco; Arcas, Aurelia; Bautista, Delia; Vicente, José","Synthesis and Hydrolysis of Cationic Palladium(II) 2,6-Diacetylpyridine Dimethyl Ketal Complexes. Cyclopalladation of 2,6-Diacetylpyridine. Palladium-Catalyzed Synthesis of a 1,5-Benzodiazepine†","Organometallics","2012","31","9","3736","","10.1021/om300217k","","","0.71073","MoKα","","0.027","0.0253","","","0.0614","0.0624","","","","","","1.058","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078291","7.6698","0.0004","23.7216","0.0012","7.8644","0.0004","90","","104.965","0.002","90","","1382.32","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 Cl N2 O6 Pd -","- C11 H11 Cl N2 O6 Pd -","- C44 H44 Cl4 N8 O24 Pd4 -","4","1","","Juliá-Hernández, Francisco; Arcas, Aurelia; Bautista, Delia; Vicente, José","Synthesis and Hydrolysis of Cationic Palladium(II) 2,6-Diacetylpyridine Dimethyl Ketal Complexes. Cyclopalladation of 2,6-Diacetylpyridine. Palladium-Catalyzed Synthesis of a 1,5-Benzodiazepine†","Organometallics","2012","31","9","3736","","10.1021/om300217k","","","0.71073","MoKα","","0.0234","0.0225","","","0.056","0.0565","","","","","","1.102","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078292","12.9833","0.0002","18.9236","0.0003","22.7786","0.0002","90","","90","","90","","5596.49","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C31 H40 B Fe2 P -","- C31 H40 B Fe2 P -","- C248 H320 B8 Fe16 P8 -","8","2","","Barreiro, Elena M.; Broggini, Diego F. D.; Adrio, Luis A.; White, Andrew J. P.; Schwenk, Rino; Togni, Antonio; Hii, King Kuok (Mimi)","Gold(I) Complexes of Conformationally Constricted Chiral Ferrocenyl Phosphines","Organometallics","2012","31","9","3745","","10.1021/om300222k","","","0.71073","MoKα","","0.0632","0.0401","","","0.0698","0.0779","","","","","","1.087","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078293","8.8418","0.0002","10.4886","0.0003","16.5551","0.0004","90","","94.877","0.001","90","","1529.73","0.07","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H40 Fe2 P2 -","- C36 H40 Fe2 P2 -","- C72 H80 Fe4 P4 -","2","1","","Barreiro, Elena M.; Broggini, Diego F. D.; Adrio, Luis A.; White, Andrew J. P.; Schwenk, Rino; Togni, Antonio; Hii, King Kuok (Mimi)","Gold(I) Complexes of Conformationally Constricted Chiral Ferrocenyl Phosphines","Organometallics","2012","31","9","3745","","10.1021/om300222k","","","0.71073","MoKα","","0.0496","0.0365","","","0.0833","0.0931","","","","","","0.988","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078294","11.18245","0.00008","12.26925","0.00008","17.17066","0.00011","90","","90","","90","","2355.82","0.03","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 Au Cl Fe O P -","- C25 H25 Au Cl Fe O P -","- C100 H100 Au4 Cl4 Fe4 O4 P4 -","4","1","","Barreiro, Elena M.; Broggini, Diego F. D.; Adrio, Luis A.; White, Andrew J. P.; Schwenk, Rino; Togni, Antonio; Hii, King Kuok (Mimi)","Gold(I) Complexes of Conformationally Constricted Chiral Ferrocenyl Phosphines","Organometallics","2012","31","9","3745","","10.1021/om300222k","","","1.54184","CuKα","","0.0199","0.0183","","","0.0427","0.0433","","","","","","1.035","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078295","7.21077","0.00017","18.2833","0.0004","20.809","0.0005","90","","90","","90","","2743.39","0.11","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37 Au Cl Fe2 P -","- C31 H37 Au Cl Fe2 P -","- C124 H148 Au4 Cl4 Fe8 P4 -","4","1","","Barreiro, Elena M.; Broggini, Diego F. D.; Adrio, Luis A.; White, Andrew J. P.; Schwenk, Rino; Togni, Antonio; Hii, King Kuok (Mimi)","Gold(I) Complexes of Conformationally Constricted Chiral Ferrocenyl Phosphines","Organometallics","2012","31","9","3745","","10.1021/om300222k","","","0.71073","MoKα","","0.0285","0.0231","","","0.0326","0.0332","","","","","","0.993","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078296","11.9744","0.0004","8.9423","0.0003","18.3431","0.0005","90","","96.613","0.003","90","","1951.09","0.11","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C36.5 H40.5 Au2 Cl3.5 Fe2 P2 -","- C36.5 H40.5 Au2 Cl3.5 Fe2 P2 -","- C73 H81 Au4 Cl7 Fe4 P4 -","2","1","","Barreiro, Elena M.; Broggini, Diego F. D.; Adrio, Luis A.; White, Andrew J. P.; Schwenk, Rino; Togni, Antonio; Hii, King Kuok (Mimi)","Gold(I) Complexes of Conformationally Constricted Chiral Ferrocenyl Phosphines","Organometallics","2012","31","9","3745","","10.1021/om300222k","","","0.71073","MoKα","","0.0699","0.0434","","","0.1015","0.1101","","","","","","1.076","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078297","10.199","0.002","10.922","0.003","13.664","0.004","82.687","0.006","87.793","0.008","76.674","0.008","1469","0.7","200","","","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H42 N O P Ru -","- C35 H42 N O P Ru -","- C70 H84 N2 O2 P2 Ru2 -","2","1","","Hirano, Masafumi; Arai, Yasutomo; Hamamura, Yuka; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric and Catalytic Cross Dimerization between Conjugated Dienes and Conjugated Carbonyls by a Ruthenium(0) Complex: Straightforward Access to Unsaturated Carbonyl Compounds by an Oxidative Coupling Mechanism","Organometallics","2012","31","10","4006","","10.1021/om300234d","","","0.71075","MoKα","","","0.0302","","","","0.08","","","","","","1.053","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078298","8.464","0.003","10.961","0.003","11.182","0.003","84.032","0.01","86.657","0.011","69.827","0.006","968.2","0.5","200","","200","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H31 N O2 Ru -","- C20 H31 N O2 Ru -","- C40 H62 N2 O4 Ru2 -","2","1","","Hirano, Masafumi; Arai, Yasutomo; Hamamura, Yuka; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric and Catalytic Cross Dimerization between Conjugated Dienes and Conjugated Carbonyls by a Ruthenium(0) Complex: Straightforward Access to Unsaturated Carbonyl Compounds by an Oxidative Coupling Mechanism","Organometallics","2012","31","10","4006","","10.1021/om300234d","","","0.71075","MoKα","","","0.0401","","","","0.1183","","","","","","1.227","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078299","14.246","0.005","14.126","0.005","21.015","0.008","90","","93.084","0.005","90","","4223","3","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H35 N O2 Ru -","- C22 H35 N O2 Ru -","- C176 H280 N8 O16 Ru8 -","8","2","","Hirano, Masafumi; Arai, Yasutomo; Hamamura, Yuka; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric and Catalytic Cross Dimerization between Conjugated Dienes and Conjugated Carbonyls by a Ruthenium(0) Complex: Straightforward Access to Unsaturated Carbonyl Compounds by an Oxidative Coupling Mechanism","Organometallics","2012","31","10","4006","","10.1021/om300234d","","","0.71075","MoKα","","","0.0962","","","","0.2624","","","","","","1.012","","","","has coordinates","178671","2020-10-21","18:00:00",""
"4078300","9.2102","0.0006","12.6539","0.0009","12.6874","0.001","90.723","0.003","102.64","0.003","107.248","0.007","1373.16","0.18","93","2","93","2","","","","","","","","5","P -1","-P 1","2","Bbp2Al2Br2","1,2-Bis(2,6-bis(bis(trimethylsilyl)methyl)phenyl)-1,2-dibromodialumane","","- C40 H82 Al2 Br2 Si8 -","- C40 H82 Al2 Br2 Si8 -","- C40 H82 Al2 Br2 Si8 -","1","0.5","","Agou, Tomohiro; Nagata, Koichi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","Synthesis, Structure, and Properties of a Stable 1,2-Dibromodialumane(4) Bearing a Bulky Aryl Substituent","Organometallics","2012","31","9","3806","","10.1021/om300237q","","x-ray","0.71069","MoKα","","0.0893","0.0475","","","0.0935","0.123","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078301","9.5433","0.0001","27.0804","0.0004","13.4611","0.0002","90","","98.1654","0.0006","90","","3443.57","0.08","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","BbpAlBrOEt2","2,6-bis(bis(trimethylsilyl)methyl)phenyl-dibromoalumane diethylether complex","","- C24 H51 Al Br2 O Si4 -","- C24 H51 Al Br2 O Si4 -","- C96 H204 Al4 Br8 O4 Si16 -","4","1","","Agou, Tomohiro; Nagata, Koichi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","Synthesis, Structure, and Properties of a Stable 1,2-Dibromodialumane(4) Bearing a Bulky Aryl Substituent","Organometallics","2012","31","9","3806","","10.1021/om300237q","","x-ray","0.71075","MoKα","","0.0304","0.025","","","0.0637","0.0661","","","","","","1.025","","","","has coordinates","213925","2020-10-21","18:00:00",""
"4078302","11.246","0.0003","14.1233","0.0004","27.1842","0.0008","90","","100.079","0.001","90","","4251.1","0.2","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H60 Mg N4 O -","- C47 H60 Mg N4 O -","- C188 H240 Mg4 N16 O4 -","4","1","","Summerscales, Owen T.; Myers, Thomas W.; Berben, Louise A.","Mild Reduction Route to a Redox-Active Silicon Complex: Structure and Properties of (IP2–)2Si and (IP–)2Mg(THF) (IP = α-Iminopyridine)","Organometallics","2012","31","9","3463","","10.1021/om300242q","","","0.71073","MoKα","","0.0695","0.0438","","","0.1031","0.1146","","","","","","1.022","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078303","10.118","0.002","10.452","0.003","16.633","0.003","90.86","0.03","90.354","0.017","114.433","0.01","1601.1","0.6","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H44 N4 Si -","- C36 H44 N4 Si -","- C72 H88 N8 Si2 -","2","1","","Summerscales, Owen T.; Myers, Thomas W.; Berben, Louise A.","Mild Reduction Route to a Redox-Active Silicon Complex: Structure and Properties of (IP2‒)2Si and (IP‒)2Mg(THF) (IP = α-Iminopyridine)","Organometallics","2012","31","9","3463","","10.1021/om300242q","","","0.71073","MoKα","","0.0639","0.0408","","","0.0916","0.1041","","","","","","1.028","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078304","10.5748","0.0004","16.2861","0.0005","22.4857","0.0008","90","","93.622","0.001","90","","3864.8","0.2","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H54 Ge N2 -","- C48 H54 Ge N2 -","- C192 H216 Ge4 N8 -","4","1","","Brown, Zachary D.; Guo, Jing-Dong; Nagase, Shigeru; Power, Philip P.","Experimental and Computational Study of Auxiliary Molecular Effects on the Mechanism of the Addition of Hydrazines to a Low-Valent Germanium Complex","Organometallics","2012","31","9","3768","","10.1021/om300271c","","","1.54178","CuKα","","0.041","0.0406","","","0.1058","0.1061","","","","","","1.053","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078305","10.8998","0.0007","16.5284","0.0011","22.2944","0.0014","90","","92.666","0.002","90","","4012.1","0.4","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C49 H57 Ge N2 -","- C49 H57 Ge N2 -","- C196 H228 Ge4 N8 -","4","1","","Brown, Zachary D.; Guo, Jing-Dong; Nagase, Shigeru; Power, Philip P.","Experimental and Computational Study of Auxiliary Molecular Effects on the Mechanism of the Addition of Hydrazines to a Low-Valent Germanium Complex","Organometallics","2012","31","9","3768","","10.1021/om300271c","","","1.54178","CuKα","","0.0573","0.0571","","","0.1352","0.1353","","","","","","1.274","","","","has coordinates,has disorder","178672","2020-10-21","18:00:00",""
"4078306","18.9994","0.0008","30.2957","0.0013","14.1667","0.0006","90","","90","","90","","8154.4","0.6","87","2","87","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C50 H58 Ge0.96 N2 -","- C50 H58 Ge0.958 N2 -","- C400 H464 Ge7.664 N16 -","8","1","","Brown, Zachary D.; Guo, Jing-Dong; Nagase, Shigeru; Power, Philip P.","Experimental and Computational Study of Auxiliary Molecular Effects on the Mechanism of the Addition of Hydrazines to a Low-Valent Germanium Complex","Organometallics","2012","31","9","3768","","10.1021/om300271c","","","1.54178","CuKα","","0.0621","0.0506","","","0.1382","0.1485","","","","","","0.854","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078307","12.303","0.0001","17.468","0.0002","13.819","0.0002","90","","98.485","0.001","90","","2937.32","0.06","193","2","193","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","[Pt(dippe)(η2-(C,S-DBTO2)]","","- C29 H43 O2 P2 Pt S -","- C29 H43 O2 P2 Pt S -","- C116 H172 O8 P8 Pt4 S4 -","4","1","","Oviedo, Alberto; Arévalo, Alma; Flores-Alamo, Marcos; García, Juventino J.","Mechanistic Insights into the C‒S Bond Breaking in Dibenzothiophene Sulfones","Organometallics","2012","31","10","4039","","10.1021/om3002729","","x-ray","0.71073","MoKα","","0.0206","0.0151","","","0.034","0.0347","","","","","","1.004","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078308","11.1087","0.0001","16.7375","0.0002","17.0714","0.0002","90","","93.139","0.001","90","","3169.35","0.06","193","2","193","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H86 O8 P4 Pt2 S4 -","- C58 H86 O8 P4 Pt2 S4 -","- C116 H172 O16 P8 Pt4 S8 -","2","0.5","","Oviedo, Alberto; Arévalo, Alma; Flores-Alamo, Marcos; García, Juventino J.","Mechanistic Insights into the C–S Bond Breaking in Dibenzothiophene Sulfones","Organometallics","2012","31","10","4039","","10.1021/om3002729","","x-ray","0.71073","MoKα","","0.0249","0.018","","","0.0369","0.0378","","","","","","0.999","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078309","10.9329","0.0004","12.1376","0.0004","14.7338","0.0005","78.801","0.002","82.497","0.002","69.455","0.001","1791.8","0.11","100","2","100","2","","","","","","","","7","P -1","-P 1","2","(CF3)FI-Ni","[2-tert-butyl-6-((2,6-(3,5-bistrifluoromethyl-phenyl)phenylimino) methyl)phenolato]-Ni(II)-methyl-(trimethylphosphine)","","- C37 H34 F12 N Ni O P -","- C37 H34 F12 N Ni O P -","- C74 H68 F24 N2 Ni2 O2 P2 -","2","1","","Weberski, Michael P.; Chen, Changle; Delferro, Massimiliano; Zuccaccia, Cristiano; Macchioni, Alceo; Marks, Tobin J.","Suppression of β-Hydride Chain Transfer in Nickel(II)-Catalyzed Ethylene Polymerization via Weak Fluorocarbon Ligand‒Product Interactions","Organometallics","2012","31","9","3773","","10.1021/om3002735","","","0.71073","MoKα","","0.0728","0.0451","","","0.107","0.119","","","","","","0.964","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078310","11.7513","0.0008","12.4147","0.0009","14.6163","0.001","75.419","0.005","88.231","0.005","68.923","0.005","1921.4","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","(CH3)FI-Ni","[2-tert-butyl-6-((2,6-(3,5-dimethylphenyl)-phenylimino) methyl)phenolato]-Ni(II) methyl(trimethylphosphine)","","- C43 H60 N Ni O P -","- C43 H60 N Ni O P -","- C86 H120 N2 Ni2 O2 P2 -","2","1","","Weberski, Michael P.; Chen, Changle; Delferro, Massimiliano; Zuccaccia, Cristiano; Macchioni, Alceo; Marks, Tobin J.","Suppression of β-Hydride Chain Transfer in Nickel(II)-Catalyzed Ethylene Polymerization via Weak Fluorocarbon Ligand‒Product Interactions","Organometallics","2012","31","9","3773","","10.1021/om3002735","","","1.54178","CuKα","","0.0664","0.0479","","","0.1299","0.1542","","","","","","1.088","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078311","15.2118","0.0005","15.9954","0.0005","15.5796","0.0005","90","","91.033","0.002","90","","3790.2","0.2","100","2","100.02","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H36 F12 N2 Ni O -","- C42 H36 F12 N2 Ni O -","- C168 H144 F48 N8 Ni4 O4 -","4","1","","Weberski, Michael P.; Chen, Changle; Delferro, Massimiliano; Zuccaccia, Cristiano; Macchioni, Alceo; Marks, Tobin J.","Suppression of β-Hydride Chain Transfer in Nickel(II)-Catalyzed Ethylene Polymerization via Weak Fluorocarbon Ligand‒Product Interactions","Organometallics","2012","31","9","3773","","10.1021/om3002735","","","0.71073","MoKα","","0.0575","0.0392","","","0.1072","0.1146","","","","","","1.051","","","","has coordinates,has disorder","178672","2020-10-21","18:00:00",""
"4078312","11.5636","0.0006","25.3986","0.0013","9.9465","0.0005","90","","106.771","0.003","90","","2797","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(C=NCF3)FI-Ni","[2-tert-butyl-6-(2,2,2-trifluoro-1-(2,6-diisopropylphenyl) imino-ethyl)phenolato]-Ni(II)-methyl-(trimethylphosphine)","","- C28 H41 F3 N Ni O P -","- C28 H41 F3 N Ni O P -","- C112 H164 F12 N4 Ni4 O4 P4 -","4","1","","Weberski, Michael P.; Chen, Changle; Delferro, Massimiliano; Zuccaccia, Cristiano; Macchioni, Alceo; Marks, Tobin J.","Suppression of β-Hydride Chain Transfer in Nickel(II)-Catalyzed Ethylene Polymerization via Weak Fluorocarbon Ligand‒Product Interactions","Organometallics","2012","31","9","3773","","10.1021/om3002735","","","0.71073","MoKα","","0.0643","0.039","","","0.0894","0.101","","","","","","1.03","","","","has coordinates,has disorder","178672","2020-10-21","18:00:00",""
"4078313","17.82","0.03","9.53","0.02","16.95","0.03","90","","98.92","0.03","90","","2844","9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(CH3)HFI","[2-tert-butyl-6-((2,6-(3,5-dimethylphenyl)-phenylimino)methyl)phenol","","- C33 H35 N O -","- C33 H35 N O -","- C132 H140 N4 O4 -","4","1","","Weberski, Michael P.; Chen, Changle; Delferro, Massimiliano; Zuccaccia, Cristiano; Macchioni, Alceo; Marks, Tobin J.","Suppression of β-Hydride Chain Transfer in Nickel(II)-Catalyzed Ethylene Polymerization via Weak Fluorocarbon Ligand–Product Interactions","Organometallics","2012","31","9","3773","","10.1021/om3002735","","","0.71073","MoKα","","0.1057","0.0723","","","0.2003","0.2412","","","","","","1.062","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078314","11.64","0.002","13.661","0.002","17.73","0.003","90.036","0.003","97.222","0.003","91.916","0.003","2795.4","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H36 Br N4 Rh -","- C30 H36 Br N4 Rh -","- C120 H144 Br4 N16 Rh4 -","4","2","","Daw, Prosenjit; Sinha, Arup; Rahaman, S. M. Wahidur; Dinda, Shrabani; Bera, Jitendra K.","Bifunctional Water Activation for Catalytic Hydration of Organonitriles","Organometallics","2012","31","9","3790","3797","10.1021/om300297y","","","0.71073","MoKα","","0.0735","0.0539","","","0.1347","0.1471","","","","","","1.014","","","","has coordinates","218788","2020-10-21","18:00:00",""
"4078315","9.8847","0.0005","14.1797","0.0008","8.584","0.0005","90","","109.873","0.001","90","","1131.5","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Mo O3 Si -","- C10 H10 Mo O3 Si -","- C40 H40 Mo4 O12 Si4 -","4","1","","Zhu, Bolin; Chen, Yunfei; Shi, Wei; Li, Yuan; Hao, Xiaoting","Reactions of Doubly SiMe2-Bridged Bis(cyclopentadienyl) Complexes of Molybdenum and Iron Carbonyls: Competitive Ring-to-Metal Migrations of Hydrogen and SiMe2","Organometallics","2012","31","10","4046","","10.1021/om300305g","","","0.71073","MoKα","","0.0216","0.0203","","","0.055","0.056","","","","","","1.073","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078316","8.5329","0.0018","13.193","0.003","13.927","0.003","86.495","0.004","78.609","0.003","89.343","0.004","1534.1","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H72 Mo4 O12 Si4 -","- C56 H72 Mo4 O12 Si4 -","- C56 H72 Mo4 O12 Si4 -","1","0.5","","Zhu, Bolin; Chen, Yunfei; Shi, Wei; Li, Yuan; Hao, Xiaoting","Reactions of Doubly SiMe2-Bridged Bis(cyclopentadienyl) Complexes of Molybdenum and Iron Carbonyls: Competitive Ring-to-Metal Migrations of Hydrogen and SiMe2","Organometallics","2012","31","10","4046","","10.1021/om300305g","","","0.71073","MoKα","","0.0827","0.0693","","","0.1603","0.1666","","","","","","1.088","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078317","16.478","0.009","9.777","0.006","12.313","0.007","90","","90","","90","","1984","2","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C72 H72 Fe8 O16 Si8 -","- C72 H72 Fe8 O16 Si8 -","- C72 H72 Fe8 O16 Si8 -","1","0.25","","Zhu, Bolin; Chen, Yunfei; Shi, Wei; Li, Yuan; Hao, Xiaoting","Reactions of Doubly SiMe2-Bridged Bis(cyclopentadienyl) Complexes of Molybdenum and Iron Carbonyls: Competitive Ring-to-Metal Migrations of Hydrogen and SiMe2","Organometallics","2012","31","10","4046","","10.1021/om300305g","","","0.71073","MoKα","","0.0445","0.0316","","","0.0577","0.0612","","","","","","1.035","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078318","10.736","0.003","11.049","0.003","14.441","0.004","72.644","0.004","70.492","0.004","61.016","0.004","1393","0.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H34 Fe2 O4 Si2 -","- C26 H34 Fe2 O4 Si2 -","- C52 H68 Fe4 O8 Si4 -","2","1","","Zhu, Bolin; Chen, Yunfei; Shi, Wei; Li, Yuan; Hao, Xiaoting","Reactions of Doubly SiMe2-Bridged Bis(cyclopentadienyl) Complexes of Molybdenum and Iron Carbonyls: Competitive Ring-to-Metal Migrations of Hydrogen and SiMe2","Organometallics","2012","31","10","4046","","10.1021/om300305g","","","0.71073","MoKα","","0.0337","0.028","","","0.0705","0.0743","","","","","","1.031","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078319","7.9573","0.0011","9.5463","0.0014","10.3479","0.0016","79.796","0.009","70.501","0.008","66.039","0.008","676.33","0.18","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 Ag2 Cl2 N4 -","- C26 H32 Ag2 Cl2 N4 -","- C26 H32 Ag2 Cl2 N4 -","1","0.5","","Su, Haw-Lih; Pérez, Lisa M.; Lee, Sheng-Jui; Reibenspies, Joseph H.; Bazzi, Hassan S.; Bergbreiter, David E.","Studies of Ligand Exchange in N-Heterocyclic Carbene Silver(I) Complexes","Organometallics","2012","31","10","4063","","10.1021/om300340w","","","0.71073","MoKα","","0.0626","0.0483","","","0.1135","0.1243","","","","","","1.054","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078320","8.032","0.008","9.723","0.01","10.336","0.011","81.54","0.011","70.999","0.01","65.941","0.01","696.8","1.2","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H32 Ag2 Br2 N4 -","- C26 H32 Ag2 Br2 N4 -","- C26 H32 Ag2 Br2 N4 -","1","0.5","","Su, Haw-Lih; Pérez, Lisa M.; Lee, Sheng-Jui; Reibenspies, Joseph H.; Bazzi, Hassan S.; Bergbreiter, David E.","Studies of Ligand Exchange in N-Heterocyclic Carbene Silver(I) Complexes","Organometallics","2012","31","10","4063","","10.1021/om300340w","","","0.71073","MoKα","","0.0606","0.0526","","","0.1566","0.1654","","","","","","1.029","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078321","17.3","0.017","17.3","0.017","16.85","0.02","90","","90","","120","","4367","8","110","2","110","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C26 H28 Ag I N4 -","- C26 H32 Ag N4 -","- C156 H192 Ag6 N24 -","6","0.5","","Su, Haw-Lih; Pérez, Lisa M.; Lee, Sheng-Jui; Reibenspies, Joseph H.; Bazzi, Hassan S.; Bergbreiter, David E.","Studies of Ligand Exchange in N-Heterocyclic Carbene Silver(I) Complexes","Organometallics","2012","31","10","4063","","10.1021/om300340w","","","0.71073","MoKα","","0.2255","0.0739","","","0.1032","0.1416","","","","","","1.004","","","","has coordinates","178672","2020-10-21","18:00:00",""
"4078322","11.201","0.012","9.608","0.011","16.174","0.013","90","","132.85","0.05","90","","1276","2","110","2","110","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C26 H32 Ag I N4 -","- C26 H32 Ag I N4 -","- C52 H64 Ag2 I2 N8 -","2","0.5","","Su, Haw-Lih; Pérez, Lisa M.; Lee, Sheng-Jui; Reibenspies, Joseph H.; Bazzi, Hassan S.; Bergbreiter, David E.","Studies of Ligand Exchange in N-Heterocyclic Carbene Silver(I) Complexes","Organometallics","2012","31","10","4063","","10.1021/om300340w","","","0.71073","MoKα","","0.1106","0.076","","","0.1834","0.2425","","","","","","1.08","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078323","19.088","0.0004","20.962","0.0004","23.402","0.0006","90","","90","0.001","90","","9363.7","0.4","200","2","200","2","","","","","","","","7","P c n b","-P 2b 2ac","60","","","","- C84 H94 Cl4 Fe2 N14 O26 Zn2 -","- C84 H94 Cl4 Fe2 N14 O26 Zn2 -","- C336 H376 Cl16 Fe8 N56 O104 Zn8 -","4","0.5","","Lee, Way-Zen; Wang, Tzu-Li; Chang, Hao-Ching; Chen, Yi-Ting; Kuo, Ting-Shen","A Bioinspired ZnII/FeIIIHeterobimetallic Catalyst for Thia-Michael Addition","Organometallics","2012","31","11","4106","4109","10.1021/om300275a","","","0.71073","MoKα","","0.1724","0.0899","","","0.2175","0.2787","","","","","","1.124","","","","has coordinates,has disorder","178672","2020-10-21","18:00:00",""
"4078410","10.1315","0.0005","10.2865","0.0005","11.0789","0.0005","90","","102.196","0.001","90","","1128.56","0.09","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C20 H31 N3 O Si2 Zn -","- C20 H31 N3 O Si2 Zn -","- C40 H62 N6 O2 Si4 Zn2 -","2","1","","Roberts, Courtney C.; Barnett, Brandon R.; Green, David B.; Fritsch, Joseph M.","Synthesis and Structures of Tridentate Ketoiminate Zinc Complexes That Act Asl-Lactide Ring-Opening Polymerization Catalysts","Organometallics","2012","31","11","4133","","10.1021/om200865w","","","0.71073","MoKα","","0.022","0.0208","","","0.0468","0.0471","","","","","","1.016","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078411","9.2547","0.0019","11.502","0.002","12.095","0.003","84.188","0.002","70.629","0.002","77.106","0.002","1183.5","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H33 N3 O Si2 Zn -","- C21 H33 N3 O Si2 Zn -","- C42 H66 N6 O2 Si4 Zn2 -","2","1","","Roberts, Courtney C.; Barnett, Brandon R.; Green, David B.; Fritsch, Joseph M.","Synthesis and Structures of Tridentate Ketoiminate Zinc Complexes That Act Asl-Lactide Ring-Opening Polymerization Catalysts","Organometallics","2012","31","11","4133","","10.1021/om200865w","","","0.71073","MoKα","","0.0856","0.0835","","","0.2115","0.2141","","","","","","1.033","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078412","10.6003","0.0014","15.617","0.002","16.348","0.002","90","","90.137","0.002","90","","2706.3","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H35 N3 O Si2 Zn -","- C26 H35 N3 O Si2 Zn -","- C104 H140 N12 O4 Si8 Zn4 -","4","1","","Roberts, Courtney C.; Barnett, Brandon R.; Green, David B.; Fritsch, Joseph M.","Synthesis and Structures of Tridentate Ketoiminate Zinc Complexes That Act Asl-Lactide Ring-Opening Polymerization Catalysts","Organometallics","2012","31","11","4133","","10.1021/om200865w","","","0.71073","MoKα","","0.0276","0.0234","","","0.0636","0.0658","","","","","","1.033","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078413","13.19","0.005","15.909","0.006","16.342","0.006","102.805","0.004","93.256","0.003","94.205","0.004","3325","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H40 Cl2 N2 O2 Zn -","- C35 H40 Cl2 N2 O2 Zn -","- C140 H160 Cl8 N8 O8 Zn4 -","4","2","","Roberts, Courtney C.; Barnett, Brandon R.; Green, David B.; Fritsch, Joseph M.","Synthesis and Structures of Tridentate Ketoiminate Zinc Complexes That Act Asl-Lactide Ring-Opening Polymerization Catalysts","Organometallics","2012","31","11","4133","","10.1021/om200865w","","","0.71073","MoKα","","0.0777","0.0485","","","0.1043","0.115","","","","","","1.033","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078414","16.5418","0.0014","11.0451","0.0007","19.3782","0.0015","90","","93.232","0.007","90","","3534.9","0.5","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","compound 5a","","","- C22 H25 P -","- C22 H25 P -","- C176 H200 P8 -","8","1","","Lichtenberg, Crispin; Hillesheim, Nina S.; Elfferding, Michael; Oelkers, Benjamin; Sundermeyer, Jörg","New Lithium Phosphonium Diylides: A Methylene and a Cyclopentadienyl Moiety as Ylidic Coordination Sites","Organometallics","2012","31","11","4259","","10.1021/om201182y","","","0.71073","MoKα","","0.1075","0.0421","","","0.046","0.0547","","","","","","0.708","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078415","8.5472","0.0004","11.2691","0.0006","19.6735","0.0009","91.412","0.004","90.728","0.004","100.064","0.004","1864.93","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","compound 9","","","- C44 H48 Li2 P2 -","- C44 H48 Li2 P2 -","- C88 H96 Li4 P4 -","2","1","","Lichtenberg, Crispin; Hillesheim, Nina S.; Elfferding, Michael; Oelkers, Benjamin; Sundermeyer, Jörg","New Lithium Phosphonium Diylides: A Methylene and a Cyclopentadienyl Moiety as Ylidic Coordination Sites","Organometallics","2012","31","11","4259","","10.1021/om201182y","","","0.71069","MoKα","","0.0516","0.0344","","","0.0822","0.0859","","","","","","0.895","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078416","11.351","0.0005","11.7633","0.0004","13.1256","0.0005","90","","90","","90","","1752.6","0.12","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","compound 5b","","","- C22 H25 P -","- C22 H25 P -","- C88 H100 P4 -","4","1","","Lichtenberg, Crispin; Hillesheim, Nina S.; Elfferding, Michael; Oelkers, Benjamin; Sundermeyer, Jörg","New Lithium Phosphonium Diylides: A Methylene and a Cyclopentadienyl Moiety as Ylidic Coordination Sites","Organometallics","2012","31","11","4259","","10.1021/om201182y","","","0.71069","MoKα","","0.0385","0.0312","","","0.0691","0.0707","","","","","","0.928","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078417","10.1573","0.0004","12.5949","0.0005","15.509","0.0007","95.988","0.003","105.581","0.003","97.631","0.003","1873.76","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","compound 11","","","- C44 H48 Li2 P2 -","- C44 H48 Li2 P2 -","- C88 H96 Li4 P4 -","2","1","","Lichtenberg, Crispin; Hillesheim, Nina S.; Elfferding, Michael; Oelkers, Benjamin; Sundermeyer, Jörg","New Lithium Phosphonium Diylides: A Methylene and a Cyclopentadienyl Moiety as Ylidic Coordination Sites","Organometallics","2012","31","11","4259","","10.1021/om201182y","","","0.71069","MoKα","","0.0743","0.0458","","","0.1139","0.1215","","","","","","0.894","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078418","24.9672","0.0018","8.2802","0.0006","24.3611","0.0018","90","","97.588","0.009","90","","4992.2","0.6","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","compound 6","","","- C12 H21 P -","- C12 H21 P -","- C192 H336 P16 -","16","2","","Lichtenberg, Crispin; Hillesheim, Nina S.; Elfferding, Michael; Oelkers, Benjamin; Sundermeyer, Jörg","New Lithium Phosphonium Diylides: A Methylene and a Cyclopentadienyl Moiety as Ylidic Coordination Sites","Organometallics","2012","31","11","4259","","10.1021/om201182y","","","0.71073","MoKα","","0.1073","0.051","","","0.1119","0.1274","","","","","","0.815","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078419","10.7256","0.0016","13.681","0.002","17.613","0.002","112.668","0.002","93.344","0.003","105.922","0.002","2253.8","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H41 Fe N2 -","- C59 H41 Fe N2 -","- C118 H82 Fe2 N4 -","2","1","","Ramakrishnan, S.; Anju, K. S.; Thomas, Ajesh P.; Gowri Sreedevi, K. C.; Salini, P. S.; Derry Holaday, M. G.; Suresh, Eringathodi; Srinivasan, A.","ansa-Ferrocene-Incorporated Calixpyrroles and Calixphyrins: Syntheses and Spectral/Structural Characterization","Organometallics","2012","31","11","4166","","10.1021/om300004m","","","0.71073","MoKα","","0.096","0.0715","","","0.183","0.1944","","","","","","1.043","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078420","10.8554","0.0014","13.2066","0.0017","17.776","0.002","99.425","0.002","101.517","0.002","94.053","0.002","2449.3","0.5","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H45 Cl3 Fe N2 S -","- C63 H45 Cl3 Fe N2 S -","- C126 H90 Cl6 Fe2 N4 S2 -","2","1","","Ramakrishnan, S.; Anju, K. S.; Thomas, Ajesh P.; Gowri Sreedevi, K. C.; Salini, P. S.; Derry Holaday, M. G.; Suresh, Eringathodi; Srinivasan, A.","ansa-Ferrocene-Incorporated Calixpyrroles and Calixphyrins: Syntheses and Spectral/Structural Characterization","Organometallics","2012","31","11","4166","","10.1021/om300004m","","","0.71073","MoKα","","0.0673","0.0608","","","0.145","0.1491","","","","","","1.119","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078421","16.4365","0.0015","9.8425","0.0009","23.296","0.002","90","","91.443","0.002","90","","3767.5","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C52 H40 Fe N2 -","- C52 H40 Fe N2 -","- C208 H160 Fe4 N8 -","4","1","","Ramakrishnan, S.; Anju, K. S.; Thomas, Ajesh P.; Gowri Sreedevi, K. C.; Salini, P. S.; Derry Holaday, M. G.; Suresh, Eringathodi; Srinivasan, A.","ansa-Ferrocene-Incorporated Calixpyrroles and Calixphyrins: Syntheses and Spectral/Structural Characterization","Organometallics","2012","31","11","4166","","10.1021/om300004m","","","0.71073","MoKα","","0.0841","0.0642","","","0.1305","0.1383","","","","","","1.129","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078422","9.8453","0.0004","10.2772","0.0004","19.8022","0.0008","97.231","0.003","91.26","0.002","95.104","0.002","1978.69","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H37 B Cl2 F4 Mo O4 -","- C45 H37 B Cl2 F4 Mo O4 -","- C90 H74 B2 Cl4 F8 Mo2 O8 -","2","1","","Antunes, M. Augusta; Alves, Luis G.; Namorado, Sónia; Ascenso, José R.; Veiros, Luis F.; Martins, Ana M.","Hydride Abstraction from [MCpBz(CO)3H] (M = Mo, W; CpBz= C5(CH2Ph)5): New Cationic Complexes Stabilized by η5:η2-C5H4:C6H5Bonding of the Pentabenzylcyclopentadienyl Ligand","Organometallics","2012","31","12","4387","","10.1021/om300070m","","","0.71073","MoKα","","0.0514","0.0361","","","0.078","0.0819","","","","","","1.036","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078423","9.8487","0.0003","10.2715","0.0003","19.808","0.0006","97.23","0.003","91.264","0.002","95.034","0.002","1979.08","0.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H37 B Cl2 F4 O4 W -","- C45 H37 B Cl2 F4 O4 W -","- C90 H74 B2 Cl4 F8 O8 W2 -","2","1","","Antunes, M. Augusta; Alves, Luis G.; Namorado, Sónia; Ascenso, José R.; Veiros, Luis F.; Martins, Ana M.","Hydride Abstraction from [MCpBz(CO)3H] (M = Mo, W; CpBz= C5(CH2Ph)5): New Cationic Complexes Stabilized by η5:η2-C5H4:C6H5Bonding of the Pentabenzylcyclopentadienyl Ligand","Organometallics","2012","31","12","4387","","10.1021/om300070m","","","0.71073","MoKα","","0.032","0.0263","","","0.0592","0.0606","","","","","","1.04","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078424","9.2391","0.0013","9.9204","0.0014","10.226","0.0015","115.841","0.002","90.15","0.002","113.948","0.002","752.34","0.19","144.5","0.2","144.5","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H23 Mg N O -","- C14 H23 Mg N O -","- C28 H46 Mg2 N2 O2 -","2","1","","Wang, Yang; Zhao, Wei; Liu, Dongtao; Li, Shihui; Liu, Xinli; Cui, Dongmei; Chen, Xuesi","Magnesium and Zinc Complexes Supported byN,O-Bidentate Pyridyl Functionalized Alkoxy Ligands: Synthesis and Immortal ROP of ε-CL andl-LA","Organometallics","2012","31","11","4182","","10.1021/om300113p","","","0.71073","MoKα","","0.0618","0.0514","","","0.1295","0.1383","","","","","","1.04","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078425","9.1722","0.0007","9.2924","0.0007","9.3428","0.0007","113.969","0.001","96.367","0.001","115.246","0.001","618.01","0.08","144.5","0.2","144.5","0.2","","","","","","","","5","P 1","P 1","1","","","","- C24 H38 N2 O2 Zn2 -","- C24 H38 N2 O2 Zn2 -","- C24 H38 N2 O2 Zn2 -","1","1","","Wang, Yang; Zhao, Wei; Liu, Dongtao; Li, Shihui; Liu, Xinli; Cui, Dongmei; Chen, Xuesi","Magnesium and Zinc Complexes Supported byN,O-Bidentate Pyridyl Functionalized Alkoxy Ligands: Synthesis and Immortal ROP of ε-CL andl-LA","Organometallics","2012","31","11","4182","","10.1021/om300113p","","","0.71073","MoKα","","0.0226","0.0209","","","0.0548","0.0559","","","","","","1.096","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078426","10.8501","0.0005","11.5735","0.0005","11.8514","0.0005","118.604","0.001","92.056","0.001","97.707","0.001","1286.19","0.1","185","2","185","2","","","","","","","","5","P 1","P 1","1","","","","- C59 H70 N2 O4 Zn2 -","- C59 H70 N2 O4 Zn2 -","- C59 H70 N2 O4 Zn2 -","1","1","","Wang, Yang; Zhao, Wei; Liu, Dongtao; Li, Shihui; Liu, Xinli; Cui, Dongmei; Chen, Xuesi","Magnesium and Zinc Complexes Supported byN,O-Bidentate Pyridyl Functionalized Alkoxy Ligands: Synthesis and Immortal ROP of ε-CL andl-LA","Organometallics","2012","31","11","4182","","10.1021/om300113p","","","0.71073","MoKα","","0.0355","0.032","","","0.0804","0.0835","","","","","","1.105","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078427","11.5485","0.0003","11.1502","0.0003","14.8159","0.0004","90","","103.49","0.002","90","","1855.18","0.09","220","2","220","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H28 N4 O Zn -","- C17 H28 N4 O Zn -","- C68 H112 N16 O4 Zn4 -","4","1","","Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Tejeda, Juan; Honrado, Manuel; Garcés, Andrés; Lara-Sánchez, Agustín; Rodríguez, Ana M.","ChiralN,N,O-Scorpionate Zinc Alkyls as Effective and Stereoselective Initiators for the Living ROP of Lactides","Organometallics","2012","31","11","4191","","10.1021/om300146n","","","0.71073","MoKα","","0.0598","0.0382","","","0.084","0.0924","","","","","","1.036","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078428","9.0973","0.0011","11.1423","0.0015","13.1146","0.0016","101.709","0.008","92.045","0.01","90.519","0.007","1300.7","0.3","230","2","230","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H76 N8 O2 Zn2 -","- C50 H76 N8 O2 Zn2 -","- C50 H76 N8 O2 Zn2 -","1","0.5","","Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Tejeda, Juan; Honrado, Manuel; Garcés, Andrés; Lara-Sánchez, Agustín; Rodríguez, Ana M.","ChiralN,N,O-Scorpionate Zinc Alkyls as Effective and Stereoselective Initiators for the Living ROP of Lactides","Organometallics","2012","31","11","4191","","10.1021/om300146n","","","0.71073","MoKα","","0.052","0.041","","","0.0986","0.104","","","","","","1.082","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078429","10.3813","0.0009","10.674","0.001","11.9827","0.0012","88.302","0.006","73.59","0.007","71.206","0.006","1203","0.2","230","2","230","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H72 N8 O2 Si2 Zn2 -","- C40 H72 N8 O2 Si2 Zn2 -","- C40 H72 N8 O2 Si2 Zn2 -","1","0.5","","Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Tejeda, Juan; Honrado, Manuel; Garcés, Andrés; Lara-Sánchez, Agustín; Rodríguez, Ana M.","ChiralN,N,O-Scorpionate Zinc Alkyls as Effective and Stereoselective Initiators for the Living ROP of Lactides","Organometallics","2012","31","11","4191","","10.1021/om300146n","","","0.71073","MoKα","","0.0913","0.0556","","","0.1514","0.1873","","","","","","0.856","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078430","9.0504","0.0005","10.578","0.0005","12.6055","0.0006","66.139","0.002","82.399","0.003","65.589","0.002","1004.1","0.09","230","2","230","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H56 N8 O2 Zn2 -","- C42 H56 N8 O2 Zn2 -","- C42 H56 N8 O2 Zn2 -","1","0.5","","Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Tejeda, Juan; Honrado, Manuel; Garcés, Andrés; Lara-Sánchez, Agustín; Rodríguez, Ana M.","ChiralN,N,O-Scorpionate Zinc Alkyls as Effective and Stereoselective Initiators for the Living ROP of Lactides","Organometallics","2012","31","11","4191","","10.1021/om300146n","","","0.71073","MoKα","","0.029","0.0266","","","0.0745","0.0766","","","","","","1.157","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078431","19.6254","0.0004","19.6254","0.0004","9.1641","0.0002","90","","90","","120","","3056.73","0.11","100","2","100","2","","","","","","","","6","P 64","P 64","172","","","","- C40 H50 Cl2 N4 O2 Ti -","- C40 H50 Cl2 N4 O2 Ti -","- C120 H150 Cl6 N12 O6 Ti3 -","3","0.5","","Tanaka, Ryo; Viehmann, Philipp; Hecht, Stefan","Bis(phenoxy-azo)titanium(IV) Complexes: Synthesis, Structure, and Catalytic Activity in Styrene Polymerization","Organometallics","2012","31","11","4216","","10.1021/om3001636","","","0.71073","MoKα","","0.0363","0.0346","","","0.0825","0.0832","","","","","","1.06","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078432","14.5556","0.0006","25.3682","0.001","11.6943","0.0005","90","","97.611","0.003","90","","4280.1","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H48 Cl4 F4 N4 O2 Ti -","- C41 H48 Cl4 F4 N4 O2 Ti -","- C164 H192 Cl16 F16 N16 O8 Ti4 -","4","1","","Tanaka, Ryo; Viehmann, Philipp; Hecht, Stefan","Bis(phenoxy-azo)titanium(IV) Complexes: Synthesis, Structure, and Catalytic Activity in Styrene Polymerization","Organometallics","2012","31","11","4216","","10.1021/om3001636","","","0.71073","MoKα","","0.1113","0.048","","","0.0778","0.0903","","","","","","0.806","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078433","8.9564","0.0001","14.6923","0.0002","16.573","0.0002","90","","90","","90","","2180.84","0.05","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H23 N3 O2 Pt -","- C26 H23 N3 O2 Pt -","- C104 H92 N12 O8 Pt4 -","4","1","","Fuertes, Sara; Woodall, Christopher H.; Raithby, Paul R.; Sicilia, Violeta","Heteropolynuclear Pt(II)‒M(I) Clusters with a C∧N∧C Biscyclometalated Ligand","Organometallics","2012","31","11","4228","","10.1021/om300170j","","","1.5418","CuKα","","0.0321","0.0281","","","0.0683","0.0707","","","","","","1.099","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078434","11.8031","0.0009","11.972","0.0009","16.1715","0.0012","73.449","0.001","78.35","0.001","80.009","0.001","2128.9","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H40 Cl2 N4 O4 Pt2 -","- C47 H40 Cl2 N4 O4 Pt2 -","- C94 H80 Cl4 N8 O8 Pt4 -","2","1","","Fuertes, Sara; Woodall, Christopher H.; Raithby, Paul R.; Sicilia, Violeta","Heteropolynuclear Pt(II)‒M(I) Clusters with a C∧N∧C Biscyclometalated Ligand","Organometallics","2012","31","11","4228","","10.1021/om300170j","","","0.7749","synchrotron","","0.0866","0.0466","","","0.1006","0.1165","","","","","","0.947","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078435","17.161","0.005","18.165","0.005","30.518","0.005","90","","90","","90","","9513","4","150","2","150","2","","","","","","","","8","P b 21 a","P -2a -2ab","29","","","","- C52 H46 Ag B F4 N6 O4 Pt2 -","- C52 H46 Ag B F4 N6 O4 Pt2 -","- C416 H368 Ag8 B8 F32 N48 O32 Pt16 -","8","2","","Fuertes, Sara; Woodall, Christopher H.; Raithby, Paul R.; Sicilia, Violeta","Heteropolynuclear Pt(II)‒M(I) Clusters with a C∧N∧C Biscyclometalated Ligand","Organometallics","2012","31","11","4228","","10.1021/om300170j","","","0.71073","MoKα","","0.1256","0.0545","","","0.0931","0.114","","","","","","1.009","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078436","8.2533","0.0012","8.2533","0.0012","27.378","0.006","90","","90","","90","","1864.9","0.6","100","2","100","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C16 H26 Cl2 Li N2 Ti -","- C16 H26 Cl2 Li N2 Ti -","- C64 H104 Cl8 Li4 N8 Ti4 -","4","0.5","","Arp, Henning; Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith; Rasmussen, Kenneth; Zark, Patrick; Müller, Thomas","Synthesis of Oligosilanyl Compounds of Group 4 Metallocenes with the Oxidation State +3.","Organometallics","2012","31","11","4309","4319","10.1021/om3001873","","","0.71073","MoKα","","0.0597","0.0568","","","0.1158","0.1171","","","","","","1.255","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078437","11.539","0.002","11.888","0.002","19.059","0.004","90","","95.56","0.03","90","","2602.1","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H34 Cl2 K O6 Zr -","- C22 H34 Cl2 K O6 Zr -","- C88 H136 Cl8 K4 O24 Zr4 -","4","1","","Arp, Henning; Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith; Rasmussen, Kenneth; Zark, Patrick; Müller, Thomas","Synthesis of Oligosilanyl Compounds of Group 4 Metallocenes with the Oxidation State +3.","Organometallics","2012","31","11","4309","4319","10.1021/om3001873","","","0.71073","MoKα","","0.0706","0.0509","","","0.1031","0.111","","","","","","1.072","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078438","22.15","0.004","15.819","0.003","18.277","0.004","90","","96.07","0.03","90","","6368","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H98 K O7.5 Si8 Zr -","- C47.161 H98 K O7.613 Si8 Zr -","- C188.644 H392 K4 O30.452 Si32 Zr4 -","4","1","","Arp, Henning; Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith; Rasmussen, Kenneth; Zark, Patrick; Müller, Thomas","Synthesis of Oligosilanyl Compounds of Group 4 Metallocenes with the Oxidation State +3.","Organometallics","2012","31","11","4309","4319","10.1021/om3001873","","","0.71073","MoKα","","0.0678","0.0494","","","0.1071","0.1148","","","","","","1.033","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078439","11.06","0.002","13.291","0.003","21.226","0.004","77.47","0.03","81.03","0.03","70.17","0.03","2853.7","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H82 Hf K O6 Si8 -","- C38 H82 Hf K O6 Si8 -","- C76 H164 Hf2 K2 O12 Si16 -","2","1","","Arp, Henning; Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith; Rasmussen, Kenneth; Zark, Patrick; Müller, Thomas","Synthesis of Oligosilanyl Compounds of Group 4 Metallocenes with the Oxidation State +3.","Organometallics","2012","31","11","4309","4319","10.1021/om3001873","","","0.71073","MoKα","","0.0882","0.0645","","","0.1209","0.1293","","","","","","1.028","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078440","13.884","0.003","15.265","0.003","27.786","0.006","90","","99.18","0.03","90","","5814","2","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H81 Hf K O6 Si8 -","- C43 H81 Hf K O6 Si8 -","- C172 H324 Hf4 K4 O24 Si32 -","4","1","","Arp, Henning; Zirngast, Michaela; Marschner, Christoph; Baumgartner, Judith; Rasmussen, Kenneth; Zark, Patrick; Müller, Thomas","Synthesis of Oligosilanyl Compounds of Group 4 Metallocenes with the Oxidation State +3.","Organometallics","2012","31","11","4309","4319","10.1021/om3001873","","","0.71073","MoKα","","0.0901","0.0667","","","0.1283","0.1377","","","","","","1.108","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078441","9.8793","0.0003","12.7041","0.0004","12.8138","0.0004","90","","90","","90","","1608.23","0.09","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","SSR26-1596 (S,S~Ox~,R~Fc~)-26","(S,S~Ox~,S~Fc~)-2-[4,5-Dihydro-4-(1-methylethyl)oxazol-2-yl)-1- [1-(hydroxy)ethyl]-ferrocene, (S,S~Ox~,S~Fc~)-26","","- C18 H23 Fe N O2 -","- C18 H23 Fe N O2 -","- C72 H92 Fe4 N4 O8 -","4","1","","Zirakzadeh, Afrooz; Schuecker, Raffael; Gorgas, Nikolaus; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter","Ruthenium Complexes of Phosphino-Substituted Ferrocenyloxazolines in the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones: A Comparison","Organometallics","2012","31","11","4241","","10.1021/om300188g","","","0.71073","MoKα","","0.0311","0.0266","","","0.0655","0.0675","","","","","","0.998","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078442","13.445","0.0004","11.3616","0.0003","13.8849","0.0004","90","","104.865","0.002","90","","2050.03","0.1","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","RRR17-1593 (R~Ox~,R~Fc~)-17","Dichloro[(4~R~,1'R,R~Fc~)-2-[4,5-dihydro-4-(1-methylethyl)oxazol-2-yl-κN) -1-[1'-(diphenylphosphino)-ethyl-κP]-ferrocene]triphenylphosphine ruthenium","","- C48 H47 Cl2 Fe N O P2 Ru -","- C48 H47 Cl2 Fe N O P2 Ru -","- C96 H94 Cl4 Fe2 N2 O2 P4 Ru2 -","2","1","","Zirakzadeh, Afrooz; Schuecker, Raffael; Gorgas, Nikolaus; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter","Ruthenium Complexes of Phosphino-Substituted Ferrocenyloxazolines in the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones: A Comparison","Organometallics","2012","31","11","4241","","10.1021/om300188g","","","0.71073","MoKα","","0.0338","0.028","","","0.064","0.0672","","","","","","1.038","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078443","10.3672","0.0004","15.3829","0.0006","29.4389","0.0012","90","","90","","90","","4694.8","0.3","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","RR44-1591 (R,R~Fc~)-44.C7H8 (toluene solv squeezed)","Dichloro[(R,R~Fc~)-2-[4,5-dihydro-4,4-dimethyloxazol-2-yl-κN)-1- [1-(diphenylphosphino)ethyl-κP]-ferrocene]triphenylphosphine ruthenium toluene solvate","","- C54 H53 Cl2 Fe N O P2 Ru -","- C47 H45 Cl2 Fe N O P2 Ru -","- C188 H180 Cl8 Fe4 N4 O4 P8 Ru4 -","4","1","","Zirakzadeh, Afrooz; Schuecker, Raffael; Gorgas, Nikolaus; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter","Ruthenium Complexes of Phosphino-Substituted Ferrocenyloxazolines in the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones: A Comparison","Organometallics","2012","31","11","4241","","10.1021/om300188g","","","0.71073","MoKα","","0.0242","0.0226","","","0.0535","0.0541","","","","","","1.107","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078444","10.0952","0.0006","11.0657","0.0006","12.6518","0.0012","105.215","0.004","96.05","0.004","115.719","0.002","1188.96","0.16","100","2","100","2","","","","","","","","8","P 1","P 1","1","RRR50-1605 (R,R~Ox~,R~Fc~)-22.CH2Cl2","Dichloro(acetonitrile)[(4R,1'R,R~Fc~))-2-[4,5-dihydro-4-(1-methylethyl) oxazol-2-yl-κN)-1-[1-(diphenylphosphino)ethyl-κP]-ferrocene] triphenylphosphine ruthenium dichloromethane solvate","","- C51 H52 Cl4 Fe N2 O P2 Ru -","- C51 H52 Cl4 Fe N2 O P2 Ru -","- C51 H52 Cl4 Fe N2 O P2 Ru -","1","1","","Zirakzadeh, Afrooz; Schuecker, Raffael; Gorgas, Nikolaus; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter","Ruthenium Complexes of Phosphino-Substituted Ferrocenyloxazolines in the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones: A Comparison","Organometallics","2012","31","11","4241","","10.1021/om300188g","","","0.71073","MoKα","","0.0424","0.0414","","","0.1064","0.1075","","","","","","1.031","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078445","11.531","0.002","21.358","0.004","22","0.004","90","","90","","90","","5418.1","1.7","299","2","299","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","SS51-1590 (S~Ox~,S~Fc~)-23.C7H8","Dichloro(acetonitrile)[(S,S~Fc~)-2-[4,5-dihydro-4-(1-methylethyl)oxazol -2-yl-κN)-1-[bis(3,5-dimethylphenyl)-phosphino-methyl-κP]-ferrocene] triphenylphosphine ruthenium toluene solvate","","- C60 H64 Cl2 Fe N2 O P2 Ru -","- C60 H64 Cl2 Fe N2 O P2 Ru -","- C240 H256 Cl8 Fe4 N8 O4 P8 Ru4 -","4","1","","Zirakzadeh, Afrooz; Schuecker, Raffael; Gorgas, Nikolaus; Mereiter, Kurt; Spindler, Felix; Weissensteiner, Walter","Ruthenium Complexes of Phosphino-Substituted Ferrocenyloxazolines in the Asymmetric Hydrogenation and Transfer Hydrogenation of Ketones: A Comparison","Organometallics","2012","31","11","4241","","10.1021/om300188g","","","0.71073","MoKα","","0.0815","0.0476","","","0.0805","0.091","","","","","","1.043","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078446","14.939","0.002","8.2123","0.0012","19.487","0.003","90","","110.396","0.003","90","","2240.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 B10 Zr -","- C20 H28 B10 Zr -","- C80 H112 B40 Zr4 -","4","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.0461","0.0347","","","0.0864","0.094","","","","","","1.035","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078447","7.9728","0.0014","10.4442","0.0018","31.469","0.005","84.831","0.003","84.646","0.003","75.807","0.003","2523.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21.75 H29 B10 Cl Zr -","- C21.75 H28.75 B10 Cl Zr -","- C87 H115 B40 Cl4 Zr4 -","4","2","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.0674","0.0476","","","0.1135","0.1275","","","","","","1.03","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078448","13.651","0.006","8.427","0.004","20.131","0.008","90","","102.878","0.008","90","","2257.6","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 B10 F Zr -","- C20 H27 B10 F Zr -","- C80 H108 B40 F4 Zr4 -","4","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.1243","0.0519","","","0.1205","0.1574","","","","","","0.997","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078449","11.0854","0.0016","9.0659","0.0014","23.525","0.004","90","","99.115","0.002","90","","2334.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H32 B10 Si Zr -","- C17 H32 B10 Si Zr -","- C68 H128 B40 Si4 Zr4 -","4","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.0453","0.035","","","0.0884","0.0951","","","","","","1.046","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078450","10.6623","0.0017","11.7305","0.0019","28.37","0.005","90","","94.829","0.003","90","","3535.8","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 B10 P Zr -","- C33 H41 B10 P Zr -","- C132 H164 B40 P4 Zr4 -","4","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.0654","0.0512","","","0.1319","0.1431","","","","","","1.072","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078451","11.6198","0.0018","8.1583","0.0012","20.357","0.003","90","","101.039","0.002","90","","1894.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 B10 Zr -","- C14 H24 B10 Zr -","- C56 H96 B40 Zr4 -","4","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.037","0.0305","","","0.0781","0.083","","","","","","1.057","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078452","10.4877","0.0017","26.632","0.004","19.416","0.003","90","","104.782","0.003","90","","5243.6","1.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 B10 Zr -","- C18 H32 B10 Zr -","- C144 H256 B80 Zr8 -","8","2","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.2297","0.0791","","","0.215","0.299","","","","","","0.95","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078453","11.725","0.0018","12.2721","0.0019","12.3955","0.0019","105.274","0.003","90.058","0.002","118.131","0.002","1500.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H35 B10 P Zr -","- C27 H35 B10 P Zr -","- C54 H70 B20 P2 Zr2 -","2","1","","Ren, Shikuo; Qiu, Zaozao; Xie, Zuowei","Reaction of Zirconocene‒Carboryne with Alkenes: Synthesis and Structure of Zirconacyclopentanes with a Carborane Auxiliary","Organometallics","2012","31","12","4435","","10.1021/om300202p","","","0.71073","MoKα","","0.0471","0.0378","","","0.0958","0.103","","","","","","1.023","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078454","12.8382","0.0016","18.667","0.002","27.09","0.004","90","","90","","90","","6492.1","1.4","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H24 Cl F3 O4 Ru S -","- C19 H24 Cl F3 O4 Ru S -","- C228 H288 Cl12 F36 O48 Ru12 S12 -","12","3","","Dubarle-Offner, Julien; Axet, M. Rosa; Chamoreau, Lise Marie; Amouri, Hani; Cooksy, Andrew L.","Enantiomerically Pure, Planar Chiral Cp*Ru Complexes: Synthesis, Molecular Structures, DFT and Coordination Properties","Organometallics","2012","31","12","4429","","10.1021/om300210c","","","0.71073","MoKα","","0.102","0.0456","","","0.0776","0.09","","","","","","0.978","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078455","12.8789","0.0003","18.7454","0.0004","27.1349","0.0005","90","","90","","90","","6550.9","0.2","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H24 Cl F3 O4 Ru S -","- C19 H24 Cl F3 O4 Ru S -","- C228 H288 Cl12 F36 O48 Ru12 S12 -","12","3","","Dubarle-Offner, Julien; Axet, M. Rosa; Chamoreau, Lise Marie; Amouri, Hani; Cooksy, Andrew L.","Enantiomerically Pure, Planar Chiral Cp*Ru Complexes: Synthesis, Molecular Structures, DFT and Coordination Properties","Organometallics","2012","31","12","4429","","10.1021/om300210c","","","0.71073","MoKα","","0.0446","0.0337","","","0.078","0.0827","","","","","","1.039","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078456","10.1595","0.0004","13.896","0.0006","17.6339","0.0007","70.633","0.001","84.29","0.001","84.716","0.001","2332.33","0.17","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H31 Ir N2 O7 -","- C22 H31 Ir N2 O7 -","- C88 H124 Ir4 N8 O28 -","4","2","","Ito, Jun-ichi; Kaneda, Tomoko; Nishiyama, Hisao","Intermolecular C‒H Bond Activation of Alkanes and Arenes by NCN Pincer Iridium(III) Acetate Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","12","4442","","10.1021/om3002137","","","0.71073","MoKα","","0.0374","0.0293","","","0.0698","0.073","","","","","","1.024","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078457","8.975","0.002","9.26","0.002","14.926","0.004","89.078","0.005","74.752","0.004","78.249","0.005","1170.8","0.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H31 Ir N2 O4 -","- C26 H31 Ir N2 O4 -","- C52 H62 Ir2 N4 O8 -","2","1","","Ito, Jun-ichi; Kaneda, Tomoko; Nishiyama, Hisao","Intermolecular C‒H Bond Activation of Alkanes and Arenes by NCN Pincer Iridium(III) Acetate Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","12","4442","","10.1021/om3002137","","","0.71073","MoKα","","0.0319","0.0311","","","0.0792","0.0797","","","","","","1.033","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078458","9.398","0.002","9.958","0.002","15.504","0.004","96.536","0.004","103.254","0.004","104.315","0.004","1345.9","0.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H41 Ir N2 O4 -","- C27 H41 Ir N2 O4 -","- C54 H82 Ir2 N4 O8 -","2","1","","Ito, Jun-ichi; Kaneda, Tomoko; Nishiyama, Hisao","Intermolecular C‒H Bond Activation of Alkanes and Arenes by NCN Pincer Iridium(III) Acetate Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","12","4442","","10.1021/om3002137","","","0.71073","MoKα","","0.044","0.0425","","","0.1051","0.1064","","","","","","1.046","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078459","29.684","0.003","21.3585","0.0017","21.512","0.002","90","","123.705","0.004","90","","11346.1","1.9","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C65 H63 B Ir O5 P3 -","- C65 H42 B Ir O5 P3 -","- C520 H336 B8 Ir8 O40 P24 -","8","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","0.1241","0.0972","","","0.187","0.2007","","","","","","1.163","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078460","11.792","0.004","11.898","0.004","20.843","0.007","96.44","0.003","100.189","0.003","105.176","0.004","2738.9","1.6","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H56 B Cl4 O3 P4 Rh -","- C59 H56 B Cl4 O3 P4 Rh -","- C118 H112 B2 Cl8 O6 P8 Rh2 -","2","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","0.1199","0.098","","","0.1972","0.2094","","","","","","1.15","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078461","12.0555","0.0011","12.11","0.0011","21.2356","0.0018","98.422","0.003","94.531","0.004","106.692","0.004","2913.5","0.5","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C64.68 H68.7 B Cl1.32 O3 P4 Rh -","- C64.68 H68.7 B Cl1.32 O3 P4 Rh -","- C129.36 H137.4 B2 Cl2.64 O6 P8 Rh2 -","2","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","0.0911","0.0727","","","0.1496","0.1587","","","","","","1.134","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078462","42.509","0.002","11.9298","0.0004","21.7156","0.0011","90","","109.072","0.002","90","","10408","0.8","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H54 B Cl2 Ir P4 -","- C58 H52 B Cl2 Ir P4 -","- C464 H416 B8 Cl16 Ir8 P32 -","8","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","0.0571","0.0529","","","0.1318","0.1346","","","","","","1.139","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078463","11.9389","0.0005","22.1383","0.0009","40.6437","0.0019","90","","90","","90","","10742.4","0.8","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C61 H62 B Ir O4 P4 -","- C61 H62 B Ir O4 P4 -","- C488 H496 B8 Ir8 O32 P32 -","8","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","0.107","0.0865","","","0.1305","0.1368","","","","","","1.286","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078464","10.0635","0.0004","33.3267","0.0013","13.3096","0.0005","90","","90.003","0.0018","90","","4463.8","0.3","200.1","","200.1","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C55 H46 Ir O P3 -","- C55 H46 Ir O P3 -","- C220 H184 Ir4 O4 P12 -","4","1","","Kameo, Hajime; Hashimoto, Yasuhiro; Nakazawa, Hiroshi","Synthesis of Iridaboratranes Bearing Phosphine-Tethered Borane: Reversible CO/PR3(R = Me, OMe, OEt) Substitution Reactions Induced by a σ-Electron-Acceptor Borane Ligand","Organometallics","2012","31","11","4251","","10.1021/om300216g","","","0.7107","MoKα","","","0.0269","","","","0.054","","","","","","1.027","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078465","23.5025","0.0019","14.4025","0.0012","10.9535","0.0009","90","","98.026","0.001","90","","3671.4","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H60 Cl2 O4 Os P2 -","- C32 H60 Cl2 O4 Os P2 -","- C128 H240 Cl8 O16 Os4 P8 -","4","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.0759","0.0351","","","0.0663","0.0765","","","","","","0.994","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078466","8.989","0.002","11.663","0.003","14.432","0.003","107.341","0.003","101.738","0.004","90.621","0.004","1409.9","0.6","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25.5 H43 Cl2 O4 Os P -","- C25.5 H43 Cl2 O4 Os P -","- C51 H86 Cl4 O8 Os2 P2 -","2","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.0554","0.0366","","","0.0837","0.092","","","","","","1.043","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078467","17.1473","0.0011","13.2268","0.0008","17.7132","0.0011","90","","109.102","0.001","90","","3796.2","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H62 Cl2 O4 Os P2 -","- C33 H62 Cl2 O4 Os P2 -","- C132 H248 Cl8 O16 Os4 P8 -","4","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.0473","0.0301","","","0.0617","0.069","","","","","","1.007","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078468","12.0804","0.0007","14.8396","0.0008","15.5905","0.0008","95.5198","0.0006","91.0671","0.0007","103.017","0.0007","2708.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H93 Cl6 P4 Ru2 -","- C43 H93 Cl6 P4 Ru2 -","- C86 H186 Cl12 P8 Ru4 -","2","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.0472","0.036","","","0.0826","0.0895","","","","","","1.046","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078469","14.3886","0.0013","21.3489","0.0019","23.201","0.002","90","","92.22","0.002","90","","7121.6","1.1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H120 Cl7 O P5 Ru3 -","- C58 H120 Cl7 O P5 Ru3 -","- C232 H480 Cl28 O4 P20 Ru12 -","4","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.0812","0.0483","","","0.1039","0.1238","","","","","","1.041","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078470","8.5966","0.0011","21.533","0.003","15.62","0.002","90","","102.284","0.002","90","","2825.2","0.6","100","2","100","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C38 H92 Cl9 O2 P4 Ru4 -","- C38 H92 Cl9 O2 P4 Ru4 -","- C76 H184 Cl18 O4 P8 Ru8 -","2","1","","Collado, Alba; Esteruelas, Miguel A.; Gulías, Moisés; Mascareñas, José L.; Oñate, Enrique","Reactions of an Osmium(IV) Complex with Allenedienes: Coordination and Intramolecular Cycloadditions","Organometallics","2012","31","12","4450","","10.1021/om300236y","","","0.71073","MoKα","","0.1047","0.0738","","","0.171","0.1921","","","","","","1.025","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078471","12.4319","0.0005","14.0115","0.0007","19.976","0.0007","90","","123.29","0.002","90","","2908.6","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H76 Cl4 Fe2 N4 -","- C54 H76 Cl4 Fe2 N4 -","- C108 H152 Cl8 Fe4 N8 -","2","0.5","","Danopoulos, Andreas A.; Braunstein, Pierre; Wesolek, Marcel; Monakhov, Kirill Yu.; Rabu, Pierre; Robert, Vincent","Three-Coordinate Iron(II) N-Heterocyclic Carbene Alkyl Complexes","Organometallics","2012","31","11","4102","","10.1021/om300245z","","x-ray","0.71073","MoKα","","0.1049","0.0495","","","0.1127","0.1323","","","","","","0.971","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078472","18.71","0.0011","15.2061","0.0009","26.7567","0.0013","90","","129.027","0.003","90","","5913.7","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H87 Cl3 Fe N4 O -","- C58 H87 Cl3 Fe N4 O -","- C232 H348 Cl12 Fe4 N16 O4 -","4","1","","Danopoulos, Andreas A.; Braunstein, Pierre; Wesolek, Marcel; Monakhov, Kirill Yu.; Rabu, Pierre; Robert, Vincent","Three-Coordinate Iron(II) N-Heterocyclic Carbene Alkyl Complexes","Organometallics","2012","31","11","4102","","10.1021/om300245z","","","0.71073","MoKα","","0.1333","0.0569","","","0.1021","0.1233","","","","","","1.002","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078473","10.8657","0.0005","19.6748","0.001","18.3887","0.0007","90","","102.853","0.002","90","","3832.6","0.3","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H60 Fe N2 Si2 -","- C35 H60 Fe N2 Si2 -","- C140 H240 Fe4 N8 Si8 -","4","0.5","","Danopoulos, Andreas A.; Braunstein, Pierre; Wesolek, Marcel; Monakhov, Kirill Yu.; Rabu, Pierre; Robert, Vincent","Three-Coordinate Iron(II) N-Heterocyclic Carbene Alkyl Complexes","Organometallics","2012","31","11","4102","","10.1021/om300245z","","","0.71073","MoKα","","0.0715","0.0457","","","0.1164","0.1373","","","","","","1.088","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078474","12.9187","0.0009","20.3203","0.0015","17.675","0.001","90","","128.676","0.003","90","","3622.3","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 Fe N2 -","- C41 H50 Fe N2 -","- C164 H200 Fe4 N8 -","4","1","","Danopoulos, Andreas A.; Braunstein, Pierre; Wesolek, Marcel; Monakhov, Kirill Yu.; Rabu, Pierre; Robert, Vincent","Three-Coordinate Iron(II) N-Heterocyclic Carbene Alkyl Complexes","Organometallics","2012","31","11","4102","","10.1021/om300245z","","","0.71073","MoKα","","0.1337","0.0525","","","0.1101","0.1364","","","","","","0.997","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078475","9.8227","0.0013","10.4789","0.0014","16.399","0.002","88.031","0.002","88.594","0.003","76.928","0.002","1643","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H49 Cl Fe N2 Si -","- C31 H49 Cl Fe N2 Si -","- C62 H98 Cl2 Fe2 N4 Si2 -","2","1","","Danopoulos, Andreas A.; Braunstein, Pierre; Wesolek, Marcel; Monakhov, Kirill Yu.; Rabu, Pierre; Robert, Vincent","Three-Coordinate Iron(II) N-Heterocyclic Carbene Alkyl Complexes","Organometallics","2012","31","11","4102","","10.1021/om300245z","","","0.71073","MoKα","","0.1206","0.0708","","","0.198","0.217","","","","","","1.092","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078476","10.5786","0.0009","15.0704","0.0013","21.3192","0.0019","90","","97.581","0.002","90","","3369.1","0.5","185","2","185","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H45 N P Sc Si2 -","- C33 H45 N P Sc Si2 -","- C132 H180 N4 P4 Sc4 Si8 -","4","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0703","0.046","","","0.1032","0.1145","","","","","","1.014","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078477","12.8035","0.0007","19.0339","0.0012","16.0092","0.0009","90","","102.792","0.001","90","","3804.6","0.4","185","2","185","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H53 N P Sc Si2 -","- C37 H53 N P Sc Si2 -","- C148 H212 N4 P4 Sc4 Si8 -","4","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.119","0.0724","","","0.1878","0.2212","","","","","","1.029","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078478","10.4412","0.0006","11.3389","0.0007","18.9326","0.0011","103.153","0.001","103.292","0.001","100.4","0.001","2059.1","0.2","185","2","185","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H61 N O P Si2 Y -","- C41 H61 N O P Si2 Y -","- C82 H122 N2 O2 P2 Si4 Y2 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0891","0.0532","","","0.0952","0.1122","","","","","","1.009","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078479","10.4379","0.0008","11.3382","0.001","18.9312","0.0015","102.768","0.007","103.164","0.006","100.469","0.007","2063.1","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H61 N O P Si2 Sm -","- C41 H61 N O P Si2 Sm -","- C82 H122 N2 O2 P2 Si4 Sm2 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71069","MoKα","","0.1","0.048","","","0.0884","0.0973","","","","","","0.712","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078480","10.5185","0.0015","11.4565","0.0016","19.097","0.003","103.105","0.017","103.463","0.017","100.589","0.016","2110.7","0.6","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H61 N Nd O P Si2 -","- C41 H61 N Nd O P Si2 -","- C82 H122 N2 Nd2 O2 P2 Si4 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0261","0.0223","","","0.054","0.0555","","","","","","1.038","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078481","20.2622","0.001","10.6935","0.0005","27.7835","0.0014","90","","106.818","0.001","90","","5762.5","0.5","185","2","185","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H40 N P -","- C33 H40 N P -","- C264 H320 N8 P8 -","8","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0826","0.0622","","","0.1495","0.162","","","","","","1.062","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078482","10.5235","0.0013","12.1911","0.0015","19.213","0.002","77.879","0.002","83.716","0.002","77.899","0.002","2350.9","0.5","185","2","185","2","","","","","","","","9","P -1","-P 1","2","","","","- C45 H69 Cl0 Li0 N O P Si2 Y -","- C45 H69 N O P Si2 Y -","- C90 H138 N2 O2 P2 Si4 Y2 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0634","0.0477","","","0.1143","0.1222","","","","","","1.04","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078483","10.6584","0.0012","13.5597","0.0016","17.494","0.002","95.119","0.002","103.459","0.002","95.31","0.002","2432.3","0.5","185","2","185","2","","","","","","","","9","P -1","-P 1","2","","","","- C45 H69 Cl Li N O P Si2 Y -","- C45 H69 Cl Li N O P Si2 Y -","- C90 H138 Cl2 Li2 N2 O2 P2 Si4 Y2 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.1358","0.0781","","","0.1675","0.1895","","","","","","1.074","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078484","9.9438","0.0006","10.8071","0.0006","19.8967","0.0012","98.062","0.001","96.699","0.001","99.546","0.001","2066.2","0.2","185","2","185","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H61 Lu N P Si2 -","- C41 H61 Lu N P Si2 -","- C82 H122 Lu2 N2 P2 Si4 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0705","0.054","","","0.1258","0.1358","","","","","","1.013","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078485","11.5603","0.0006","12.7372","0.0007","17.6573","0.001","78.932","0.001","74.166","0.001","71.196","0.001","2352.3","0.2","185","2","185","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H63 N O P Si2 Y -","- C48 H63 N O P Si2 Y -","- C96 H126 N2 O2 P2 Si4 Y2 -","2","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.0673","0.0473","","","0.112","0.1214","","","","","","1.03","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078486","11.249","0.003","18.82","0.005","18.458","0.005","90","","94.015","0.005","90","","3898.1","1.8","185","2","185","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H51 N O0 P Sc Si2 -","- C39 H51 N P Sc Si2 -","- C156 H204 N4 P4 Sc4 Si8 -","4","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.1707","0.0737","","","0.1588","0.2016","","","","","","0.99","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078487","12.748","0.0018","15.054","0.002","21.245","0.003","90","","91.198","0.003","90","","4076.2","1","185","2","185","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H55 N P Sc Si2 -","- C41 H55 N P Sc Si2 -","- C164 H220 N4 P4 Sc4 Si8 -","4","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.1639","0.0735","","","0.1391","0.1763","","","","","","0.966","","","","has coordinates,has disorder","178673","2020-10-21","18:00:00",""
"4078488","20.4246","0.0011","12.2682","0.0006","20.6234","0.0011","90","","115.967","0.001","90","","4646","0.4","185","2","185","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H63 Lu N O2 P Si2 -","- C48 H63 Lu N O2 P Si2 -","- C192 H252 Lu4 N4 O8 P4 Si8 -","4","1","","Jian, Zhongbao; Petrov, Alex R.; Hangaly, Noa K.; Li, Shihui; Rong, Weifeng; Mou, Zehuai; Rufanov, Konstantin A.; Harms, Klaus; Sundermeyer, Jörg; Cui, Dongmei","Phosphazene-Functionalized Cyclopentadienyl and Its Derivatives Ligated Rare-Earth Metal Alkyl Complexes: Synthesis, Structures, and Catalysis on Ethylene Polymerization","Organometallics","2012","31","11","4267","","10.1021/om300263p","","","0.71073","MoKα","","0.049","0.0341","","","0.0703","0.0763","","","","","","0.997","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078489","10.2751","0.0007","10.7169","0.0009","18.3052","0.0013","96.786","0.007","100.517","0.006","115.091","0.006","1751","0.3","150","0.2","150","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C30.92 H46.76 B2 I0.08 N12 U -","- C30.921 H46.763 B2 I0.079 N12 U -","- C61.842 H93.526 B4 I0.158 N24 U2 -","2","1","","Matson, Ellen M.; Forrest, William P.; Fanwick, Phillip E.; Bart, Suzanne C.","Use of Alkylsodium Reagents for the Synthesis of Trivalent Uranium Alkyl Complexes","Organometallics","2012","31","12","4467","","10.1021/om3002763","","","1.54184","CU-Kα","","0.064","0.06","","","0.163","0.167","","","","","","1.105","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4078490","12.6822","0.0008","13.1029","0.001","14.4609","0.001","78.889","0.005","66.013","0.005","84.836","0.004","2154.2","0.3","150","0.2","150","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H62 B2 N12 Si U -","- C37 H62 B2 N12 Si U -","- C74 H124 B4 N24 Si2 U2 -","2","1","","Matson, Ellen M.; Forrest, William P.; Fanwick, Phillip E.; Bart, Suzanne C.","Use of Alkylsodium Reagents for the Synthesis of Trivalent Uranium Alkyl Complexes","Organometallics","2012","31","12","4467","","10.1021/om3002763","","","1.54184","CU-Kα","","0.066","0.055","","","0.129","0.138","","","","","","1.063","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4078491","19.3062","0.0007","11.9134","0.0006","20.5103","0.0007","90","","112.352","0.003","90","","4363","0.3","150","2","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C31 H58 B I3 Li N6 O4 U -","- C31 H58 B I3 Li N6 O4 U -","- C124 H232 B4 I12 Li4 N24 O16 U4 -","4","1","","Matson, Ellen M.; Forrest, William P.; Fanwick, Phillip E.; Bart, Suzanne C.","Use of Alkylsodium Reagents for the Synthesis of Trivalent Uranium Alkyl Complexes","Organometallics","2012","31","12","4467","","10.1021/om3002763","","","1.54184","CU-Kα","","0.078","0.067","","","0.188","0.202","","","","","","1.063","","","","has coordinates","288189","2023-12-08","15:49:02",""
"4078492","12.9431","0.0006","12.9473","0.0001","14.0177","0.0004","79.24","0.015","70.22","0.011","60.124","0.011","1916.2","0.3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H40 Cl2 P4 Pd -","- C41 H40 Cl2 P4 Pd -","- C82 H80 Cl4 P8 Pd2 -","2","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.7107","MoKα","","","0.0284","","","","0.0734","","","","","","0.948","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078493","12.9466","0.0002","12.9941","0.0002","14.0856","0.0001","81.45","0.02","70.315","0.016","60.17","0.018","1935","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H42 Cl2 O P4 Pt -","- C41 H40 Cl2 O P4 Pt -","- C82 H80 Cl4 O2 P8 Pt2 -","2","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.7107","MoKα","","","0.0375","","","","0.0999","","","","","","1.023","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078494","14.7507","0.0011","22.4667","0.0014","15.8882","0.0013","90","","113.48","0.003","90","","4829.4","0.6","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H40 Cl5 O4 P4 Pd Rh3 -","- C45 H40 Cl5 O4 P4 Pd Rh3 -","- C180 H160 Cl20 O16 P16 Pd4 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0376","","","","0.0772","","","","","","0.88","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078495","14.806","0.005","22.404","0.007","15.943","0.005","90","","113.955","0.004","90","","4833","3","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H40 Cl5 O4 P4 Pt Rh3 -","- C45 H40 Cl5 O4 P4 Pt Rh3 -","- C180 H160 Cl20 O16 P16 Pt4 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0334","","","","0.0745","","","","","","0.935","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078496","9.3394","0.0003","17.9855","0.0006","32.2552","0.001","90","","90.3334","0.0016","90","","5417.9","0.3","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44.5 H43 Cl6 F6 O2 P5 Pd Rh2 -","- C44.5 H40 Cl6 F6 O2 P5 Pd Rh2 -","- C178 H160 Cl24 F24 O8 P20 Pd4 Rh8 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0565","","","","0.162","","","","","","1.086","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078497","9.3739","0.0008","18.013","0.0016","32.212","0.003","90","","90.79","0.0009","90","","5438.5","0.8","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C45 H44 Cl7 F6 O2 P5 Pt Rh2 -","- C45 H40 Cl7 F6 O2 P5 Pt Rh2 -","- C180 H160 Cl28 F24 O8 P20 Pt4 Rh8 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0473","","","","0.1263","","","","","","1.083","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078498","9.4603","0.0009","18.4033","0.0011","31.2044","0.0019","90","","98.529","0.004","90","","5372.6","0.7","153","","153","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C45 H44 Cl7 F6 Ni O2 P5 Rh2 -","- C45 H44 Cl7 F6 Ni O2 P5 Rh2 -","- C180 H176 Cl28 F24 Ni4 O8 P20 Rh8 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.7107","MoKα","","","0.0662","","","","0.1938","","","","","","1.099","","","","has coordinates","178673","2020-10-21","18:00:00",""
"4078499","28.966","0.006","28.966","0.006","9.561","0.002","90","","90","","120","","6947","3","153","2","153","2","","","","","","","","6","P -3","-P 3","147","","","","- C43 H40 Cl3 O2 P4 Rh3 -","- C43 H40 Cl3 O2 P4 Rh3 -","- C258 H240 Cl18 O12 P24 Rh18 -","6","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.7107","MoKα","","","0.0677","","","","0.2075","","","","","","0.987","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078500","12.881","0.006","19.929","0.008","21.468","0.009","90","","100.104","0.005","90","","5425","4","153","","153","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C45 H44 Cl8 F6 Hg O2 P5 Rh3 -","- C45 H44 Cl8 F6 Hg O2 P5 Rh3 -","- C180 H176 Cl32 F24 Hg4 O8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0373","","","","0.1003","","","","","","1.092","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078501","12.894","0.01","20.027","0.014","21.505","0.016","90","","99.159","0.012","90","","5482","7","153","","153","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C45 H44 Br2 Cl6 F6 Hg O2 P5 Rh3 -","- C45 H44 Br2 Cl6 F6 Hg O2 P5 Rh3 -","- C180 H176 Br8 Cl24 F24 Hg4 O8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0414","","","","0.1194","","","","","","1.117","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078502","12.896","0.004","20.279","0.006","21.529","0.007","90","","99.757","0.004","90","","5549","3","153","2","153","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C45 H44 Cl6 F6 Hg I2 O2 P5 Rh3 -","- C45 H40 Cl6 F6 Hg I2 O2 P5 Rh3 -","- C180 H160 Cl24 F24 Hg4 I8 O8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0416","","","","0.1061","","","","","","1.104","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078503","10.069","0.005","40.207","0.018","17.987","0.008","90","","90.57","0.004","90","","7282","6","153","","153","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C63 H66 Cl11 F6 Hg N2 P5 Rh3 -","- C63 H64 Cl11 F6 Hg N2 P5 Rh3 -","- C252 H256 Cl44 F24 Hg4 N8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0679","","","","0.1902","","","","","","1.063","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078504","10.164","0.007","40.57","0.03","18.108","0.013","90","","90.263","0.007","90","","7467","9","153","","153","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C62.5 H59 Br2 Cl9 F6 Hg N2 P5 Rh3 -","- C62.5 H64 Br2 Cl9 F6 Hg N2 P5 Rh3 -","- C250 H256 Br8 Cl36 F24 Hg4 N8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0632","","","","0.1919","","","","","","1.088","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078505","10.095","0.007","40.3","0.03","18.002","0.012","90","","90.68","0.012","90","","7323","9","153","","153","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C62.5 H65 Cl9 F6 Hg I2 N2 P5 Rh3 -","- C62.5 H64 Cl9 F6 Hg I2 N2 P5 Rh3 -","- C250 H256 Cl36 F24 Hg4 I8 N8 P20 Rh12 -","4","1","","Nakajima, Takayuki; Kurai, Sachi; Noda, Sayo; Zouda, Maki; Kure, Bunsho; Tanase, Tomoaki","Cyclic Trinuclear Rh2M Complexes (M = Rh, Pt, Pd, Ni) Supported bymeso-1,3-Bis[(diphenylphosphinomethyl)phenylphosphino]propane","Organometallics","2012","31","11","4283","","10.1021/om300278k","","","0.71075","MoKα","","","0.0651","","","","0.1875","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078506","22.929","0.002","17.504","0.002","10.4044","0.001","90","","90","","90","","4175.8","0.7","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","[Pd(OPiv)2]3","","","- C30 H54 O12 Pd3 -","- C30 H54 O12 Pd3 -","- C120 H216 O48 Pd12 -","4","0.5","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2‒Pd or C3‒Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.127","0.0759","","","0.1592","0.2075","","","","","","1.152","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078507","24.476","0.002","15.3364","0.0018","12.3243","0.0011","90","","90","","90","","4626.2","0.8","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","4","","","- C32 H60 O14 Pd4 -","- C32 H60 O14 Pd4 -","- C128 H240 O56 Pd16 -","4","1","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2–Pd or C3–Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.0844","0.0521","","","0.1258","0.1507","","","","","","1.063","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078508","12.3044","0.0012","13.5915","0.0015","15.5969","0.0018","102.283","0.001","97.255","0.001","113.191","0.002","2277.7","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H50 N2 O10 Pd4 -","- C44 H50 N2 O10 Pd4 -","- C88 H100 N4 O20 Pd8 -","2","1","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2–Pd or C3–Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.1757","0.0803","","","0.1909","0.2595","","","","","","1.05","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078509","10.0615","0.0009","12.7131","0.0014","13.9613","0.0016","111.25","0.03","104.54","0.002","101.35","0.02","1526.9","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H74 N2 O12 Pd4 -","- C56 H74 N2 O12 Pd4 -","- C56 H74 N2 O12 Pd4 -","1","0.5","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2–Pd or C3–Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.1146","0.0797","","","0.1982","0.2502","","","","","","1.073","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078510","10.506","0.0011","14.4096","0.0015","18.235","0.002","68.559","0.001","81.929","0.002","87.051","0.002","2544.1","0.5","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H56 Cl2 N2 O8 Pd4 -","- C48 H56 Cl2 N2 O8 Pd4 -","- C96 H112 Cl4 N4 O16 Pd8 -","2","1","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2–Pd or C3–Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.2153","0.0881","","","0.192","0.2944","","","","","","1.032","","","","has coordinates","276391","2022-06-29","09:17:06",""
"4078511","12.8613","0.0016","9.988","0.0013","18.081","0.002","90","","100.668","0.002","90","","2282.5","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H58 N2 O10 Pd4 -","- C40 H58 N2 O10 Pd4 -","- C80 H116 N4 O20 Pd8 -","2","0.5","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2–Pd or C3–Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.2062","0.0803","","","0.1885","0.2782","","","","","","1.223","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078512","10.9773","0.0011","27.127","0.002","15.4785","0.0014","90","","106.257","0.002","90","","4424.9","0.7","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H52 Cl2 N2 O8 Pd4 -","- C38 H52 Cl2 N2 O8 Pd4 -","- C152 H208 Cl8 N8 O32 Pd16 -","4","0.5","","Li, Yang; Wang, Wen-Hua; He, Ke-Han; Shi, Zhang-Jie","Mechanistic Insight into the Regioselective Palladation of Indole Derivatives: Tetranuclear Indolyl Palladacycles with High C2‒Pd or C3‒Pd Bond Selectivity","Organometallics","2012","31","12","4397","","10.1021/om300284t","","","0.71073","MoKα","","0.1714","0.0822","","","0.1874","0.2601","","","","","","1.119","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078513","7.9735","0.0006","13.8238","0.001","25.7538","0.0018","90","","95.107","0.004","90","","2827.4","0.4","110","","110","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Cl2 N3 O2 Re -","- C28 H34 Cl2 N3 O2 Re -","- C112 H136 Cl8 N12 O8 Re4 -","4","1","","Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.","Synthesis of Oxorhenium Acetyl and Benzoyl Complexes Incorporating Diamidopyridine Ligands: Implications for the Mechanism of CO Insertion","Organometallics","2012","31","11","4295","","10.1021/om3002872","","","0.71073","MoKα","","0.0699","0.039","","","0.075","0.0844","","","","","","1.028","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078514","17.067","0.006","16.635","0.007","18.941","0.007","90","","92.891","0.012","90","","5371","4","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 N3 O Re -","- C31 H34 N3 O Re -","- C248 H272 N24 O8 Re8 -","8","2","","Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.","Synthesis of Oxorhenium Acetyl and Benzoyl Complexes Incorporating Diamidopyridine Ligands: Implications for the Mechanism of CO Insertion","Organometallics","2012","31","11","4295","","10.1021/om3002872","","","0.71073","MoKα","","0.0679","0.0331","","","0.0571","0.0646","","","","","","1.036","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078515","13.536","0.005","13.995","0.004","15.66","0.006","78.11","0.018","79.25","0.02","75.795","0.018","2785.1","1.7","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 N3 O2 Re -","- C32 H34 N3 O2 Re -","- C128 H136 N12 O8 Re4 -","4","2","","Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.","Synthesis of Oxorhenium Acetyl and Benzoyl Complexes Incorporating Diamidopyridine Ligands: Implications for the Mechanism of CO Insertion","Organometallics","2012","31","11","4295","","10.1021/om3002872","","","0.71073","MoKα","","0.0869","0.0429","","","0.0724","0.0843","","","","","","1.003","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078516","16.998","0.005","18.682","0.005","20.185","0.007","90","","124.049","0.007","90","","5311","3","110","","110","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28.85 H35.74 Br0.04 N3 O Re -","- C28.85 H35.7375 Br0.0375 N3 O Re -","- C230.8 H285.9 Br0.3 N24 O8 Re8 -","8","2","","Lilly, Cassandra P.; Boyle, Paul D.; Ison, Elon A.","Synthesis of Oxorhenium Acetyl and Benzoyl Complexes Incorporating Diamidopyridine Ligands: Implications for the Mechanism of CO Insertion","Organometallics","2012","31","11","4295","","10.1021/om3002872","","","0.71073","MoKα","","0.0776","0.0356","","","0.0677","0.078","","","","","","1.024","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078517","16.11","0.009","14.099","0.008","19.575","0.012","90","","100.814","0.014","90","","4367","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H70 N5 Si2 Zr -","- C41 H70 N5 Si2 Zr -","- C164 H280 N20 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.0672","0.0386","","","0.0748","0.0852","","","","","","1.016","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078518","11.902","0.006","19.455","0.009","17.797","0.01","90","","108.79","0.008","90","","3901","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H57 N7 Si2 Zr -","- C36 H57 N7 Si2 Zr -","- C144 H228 N28 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.0604","0.0376","","","0.0791","0.0894","","","","","","1.029","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078519","14.881","0.006","15.938","0.007","22.278","0.011","71.859","0.013","75.371","0.011","67.362","0.012","4581","4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H70 N7 Si2 Zr -","- C39 H63 N7 Si2 Zr -","- C156 H252 N28 Si8 Zr4 -","4","2","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.089","0.0533","","","0.135","0.15","","","","","","1.057","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078520","12.0891","0.001","24.999","0.002","16.8649","0.0014","90","","97.037","0.002","90","","5058.4","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H76 N8 Si3 Zr -","- C43 H68 N8 Si3 Zr -","- C172 H272 N32 Si12 Zr4 -","4","1","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.0453","0.0346","","","0.0868","0.0932","","","","","","1.075","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078521","12.1836","0.0019","26.096","0.004","16.732","0.003","90","","97.041","0.003","90","","5279.7","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53.5 H78 N8 Si2 Zr -","- C53.5 H78 N8 Si2 Zr -","- C214 H312 N32 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.0791","0.0452","","","0.0997","0.1203","","","","","","1.053","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078522","14.713","0.002","10.0813","0.0015","28.87","0.004","90","","98.683","0.003","90","","4233.1","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 N6 Si2 Zr -","- C42 H62 N6 Si2 Zr -","- C168 H248 N24 Si8 Zr4 -","4","1","","Gehrmann, Thorsten; Lloret Fillol, Julio; Wadepohl, Hubert; Gade, Lutz H.","Synthesis, Characterization, and Thermal Rearrangement of Zirconium Tetraazadienyl and Pentaazadienyl Complexes","Organometallics","2012","31","12","4504","","10.1021/om300291b","","x-ray","0.71073","MoKα","","0.0937","0.0665","","","0.1776","0.1923","","","","","","1.111","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078523","11.6407","0.0002","14.0195","0.0003","24.0667","0.0004","90","","90","","90","","3927.61","0.13","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C40 H40 F12 Fe4 N2 P2 -","- C40 H40 F12 Fe4 N2 P2 -","- C160 H160 F48 Fe16 N8 P8 -","4","1","","Okazaki, Masaaki; Suto, Kosei; Kudo, Naotsugu; Takano, Masato; Ozawa, Fumiyuki","Synthesis and Structure of Cubane-Type Tetrairon Clusters Possessing μ3-Isonitrile Ligands. Reductive Coupling of Two Isonitriles on Redox-Responsive Tetrairon Reaction Sites","Organometallics","2012","31","11","4110","","10.1021/om3002944","","x-ray","0.71075","MoKα","","0.0345","0.0319","","","0.0864","0.0879","","","","","","0.993","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078524","11.6939","0.0005","20.5307","0.0009","26.4471","0.0011","90","","90","","90","","6349.5","0.5","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C40 H40 Fe4 N2 -","- C40 H40 Fe4 N2 -","- C320 H320 Fe32 N16 -","8","1","","Okazaki, Masaaki; Suto, Kosei; Kudo, Naotsugu; Takano, Masato; Ozawa, Fumiyuki","Synthesis and Structure of Cubane-Type Tetrairon Clusters Possessing μ3-Isonitrile Ligands. Reductive Coupling of Two Isonitriles on Redox-Responsive Tetrairon Reaction Sites","Organometallics","2012","31","11","4110","","10.1021/om3002944","","x-ray","0.71075","MoKα","","0.0313","0.025","","","0.0601","0.0629","","","","","","1.044","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078525","9.797","0.006","10.669","0.007","20.094","0.013","79.27","0.03","79.53","0.03","69.92","0.03","1922","2","273","","273","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H48 Cl2 Fe N4 -","- C42 H48 Cl2 Fe N4 -","- C84 H96 Cl4 Fe2 N8 -","2","1","","Hashimoto, Takayoshi; Urban, Slawomir; Hoshino, Ryoko; Ohki, Yasuhiro; Tatsumi, Kazuyuki; Glorius, Frank","Synthesis of Bis(N-heterocyclic carbene) Complexes of Iron(II) and Their Application in Hydrosilylation and Transfer Hydrogenation","Organometallics","2012","31","12","4474","","10.1021/om300298q","","","0.71075","MoKα","","","0.0489","","","","0.105","","","","","","1.002","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078526","9.1173","0.0015","25.346","0.004","32.221","0.006","90","","90","","90","","7446","2","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C80 H88 Cl4 Fe2 N8 O -","- C80 H65 Cl4 Fe2 N8 O -","- C320 H260 Cl16 Fe8 N32 O4 -","4","1","","Hashimoto, Takayoshi; Urban, Slawomir; Hoshino, Ryoko; Ohki, Yasuhiro; Tatsumi, Kazuyuki; Glorius, Frank","Synthesis of Bis(N-heterocyclic carbene) Complexes of Iron(II) and Their Application in Hydrosilylation and Transfer Hydrogenation","Organometallics","2012","31","12","4474","","10.1021/om300298q","","","0.71075","MoKα","","","0.0605","","","","0.1238","","","","","","1.007","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078527","20.835","0.007","20.799","0.006","18.861","0.006","90","","107.613","0.004","90","","7790","4","113","","113","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H54 Fe N4 -","- C44 H54 Fe N4 -","- C352 H432 Fe8 N32 -","8","1","","Hashimoto, Takayoshi; Urban, Slawomir; Hoshino, Ryoko; Ohki, Yasuhiro; Tatsumi, Kazuyuki; Glorius, Frank","Synthesis of Bis(N-heterocyclic carbene) Complexes of Iron(II) and Their Application in Hydrosilylation and Transfer Hydrogenation","Organometallics","2012","31","12","4474","","10.1021/om300298q","","","0.71075","MoKα","","","0.0737","","","","0.1703","","","","","","1.004","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078528","13.5328","0.0008","6.873","0.0004","17.8642","0.0012","90","","104.134","0.006","90","","1611.27","0.18","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Fe -","- C20 H26 Fe -","- C80 H104 Fe4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","1.54184","CuKα","","0.0468","0.0369","","","0.0952","0.099","","","","","","1.042","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078529","10.007","0.0002","16.1642","0.0002","10.9946","0.0002","90","","96.813","0.002","90","","1765.87","0.05","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 Fe O -","- C21 H26 Fe O -","- C84 H104 Fe4 O4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","1.54184","CuKα","","0.0268","0.0254","","","0.0704","0.0709","","","","","","1.113","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078530","12.3722","0.0002","9.2362","0.0002","15.8669","0.0002","90","","97.385","0.002","90","","1798.1","0.05","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H26 Fe O -","- C21 H26 Fe O -","- C84 H104 Fe4 O4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","1.54184","CuKα","","0.0357","0.0342","","","0.0876","0.0887","","","","","","1.023","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078531","14.6168","0.0002","8.2424","0.0002","19.4457","0.0004","90","","91.592","0.002","90","","2341.87","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 Fe N2 -","- C27 H38 Fe N2 -","- C108 H152 Fe4 N8 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","0.71073","MoKα","","0.0297","0.0261","","","0.0652","0.0672","","","","","","1.047","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078532","9.8454","0.0002","15.7886","0.0004","16.69","0.0004","76.568","0.002","85.622","0.002","87.456","0.002","2515.1","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H42 Fe P2 -","- C26 H42 Fe P2 -","- C104 H168 Fe4 P8 -","4","2","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","0.71073","MoKα","","0.0582","0.0401","","","0.0817","0.0885","","","","","","1.026","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078533","8.5902","0.0002","9.1456","0.0002","23.3844","0.0006","90","","95.068","0.002","90","","1829.96","0.08","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Fe I -","- C20 H26 Fe I -","- C80 H104 Fe4 I4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","1.54184","CuKα","","0.0388","0.0363","","","0.0935","0.0957","","","","","","1.048","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078534","12.2535","0.0002","9.2674","0.0002","15.9496","0.0004","90","","97.815","0.002","90","","1794.38","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Cl Fe -","- C20 H26 Cl Fe -","- C80 H104 Cl4 Fe4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","0.71073","MoKα","","0.052","0.0475","","","0.1173","0.1198","","","","","","1.11","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078535","14.1221","0.0004","9.8383","0.0003","17.0165","0.0005","90","","98.689","0.003","90","","2337.09","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Fe O -","- C28 H34 Fe O -","- C112 H136 Fe4 O4 -","4","1","","Glöckner, Andreas; Bannenberg, Thomas; Ibrom, Kerstin; Daniliuc, Constantin G.; Freytag, Matthias; Jones, Peter G.; Walter, Marc D.; Tamm, Matthias","Flexibility of an Open Indenyl Ligand in Iron(II) Complexes","Organometallics","2012","31","12","4480","","10.1021/om3003009","","","1.54184","CuKα","","0.0386","0.0321","","","0.0757","0.0789","","","","","","1.062","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078536","16.1402","0.0016","9.6784","0.0007","17.5118","0.0005","90","","97.745","0.005","90","","2710.6","0.3","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H29 Au Cl5 N3 O -","- C23 H29 Au Cl5 N3 O -","- C92 H116 Au4 Cl20 N12 O4 -","4","1","","Muuronen, Mikko; Perea-Buceta, Jesus E.; Nieger, Martin; Patzschke, Michael; Helaja, Juho","Cationic Gold Catalysis with Pyridine-Tethered Au(III) NHC-Carbenes: An Experimental and DFT Computational Study","Organometallics","2012","31","11","4320","","10.1021/om3003027","","","0.71073","MoKα","","0.0441","0.029","","","0.0526","0.0568","","","","","","1.064","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078537","9.563","0.004","11.93","0.005","14.317","0.004","78.75","0.03","71.34","0.02","69.91","0.03","1446.7","1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H28 Br Cl N P Pt -","- C33 H28 Br Cl N P Pt -","- C66 H56 Br2 Cl2 N2 P2 Pt2 -","2","1","","Crespo, Margarita; Anderson, Craig M.; Kfoury, Nicole; Font-Bardia, Mercè; Calvet, Teresa","Reductive Elimination from Cyclometalated Platinum(IV) Complexes To Form Csp2‒Csp3Bonds and Subsequent Competition between Csp2‒H and Csp3‒H Bond Activation","Organometallics","2012","31","12","4401","","10.1021/om300303a","","","0.71073","MoKα","","0.0687","0.0558","","","0.142","0.148","","","","","","1.09","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078538","10.391","0.004","11.128","0.003","13.005","0.004","78.48","0.02","76.48","0.02","79.07","0.02","1416.4","0.8","105","2","105","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H28 Br Cl N P Pt -","- C33 H28 Br Cl N P Pt -","- C66 H56 Br2 Cl2 N2 P2 Pt2 -","2","1","","Crespo, Margarita; Anderson, Craig M.; Kfoury, Nicole; Font-Bardia, Mercè; Calvet, Teresa","Reductive Elimination from Cyclometalated Platinum(IV) Complexes To Form Csp2‒Csp3Bonds and Subsequent Competition between Csp2‒H and Csp3‒H Bond Activation","Organometallics","2012","31","12","4401","","10.1021/om300303a","","","0.71073","MoKα","","0.0323","0.0315","","","0.0854","0.086","","","","","","1.106","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078539","10.2067","0.0006","15.2037","0.0009","15.5094","0.0009","99.157","0.003","103.552","0.003","99.353","0.003","2259.3","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H48 Cl8 O12 Si8 -","- C24 H48 Cl8 O12 Si8 -","- C48 H96 Cl16 O24 Si16 -","2","1","","Dias Filho, Newton L.; Portugal, Fátima C. M.; Nogueira, J. M. F.; Brandão, Paula; Félix, Vitor; Vaz, Pedro D.; Nunes, Carla D.; Veiros, Luis F.; Brito, Maria J. Villa de; Calhorda, Maria José","An Oligosilsesquioxane Cage Functionalized with Molybdenum(II) Organometallic Fragments","Organometallics","2012","31","12","4495","","10.1021/om3003043","","","0.71073","MoKα","","0.0928","0.0585","","","0.1606","0.1908","","","","","","1.054","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078540","13.7822","0.0004","14.3724","0.0004","20.1608","0.0006","90","","90.656","0.002","90","","3993.3","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C88 H112 Ga2 N4 O4 Sm -","- C88 H112 Ga2 N4 O4 Sm -","- C176 H224 Ga4 N8 O8 Sm2 -","2","0.5","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.0254","0.0196","","","0.0491","0.0501","","","","","","1.003","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078541","12.7406","0.0007","15.4964","0.0005","24.3631","0.0011","90","","99.393","0.004","90","","4745.6","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C103 H136 Ga2 N4 O6 Sm -","- C103 H136 Ga2 N4 O6 Sm -","- C206 H272 Ga4 N8 O12 Sm2 -","2","0.5","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.0539","0.0333","","","0.0699","0.0749","","","","","","0.91","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078542","12.611","0.003","15.433","0.003","24.211","0.005","90","","99.49","0.03","90","","4647.6","1.8","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C103 H136 Eu Ga2 N4 O6 -","- C103 H136 Eu Ga2 N4 O6 -","- C206 H272 Eu2 Ga4 N8 O12 -","2","0.5","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.0541","0.0359","","","0.0744","0.0786","","","","","","1.005","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078543","13.6617","0.0005","14.3216","0.0004","20.1983","0.0009","90","","90.575","0.003","90","","3951.7","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C88 H112 Ga2 N4 O4 Yb -","- C88 H112 Ga2 N4 O4 Yb -","- C176 H224 Ga4 N8 O8 Yb2 -","2","0.5","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.0727","0.0365","","","0.0654","0.0731","","","","","","0.881","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078544","46.0961","0.0015","20.8634","0.0009","25.2675","0.0008","90","","122.319","0.002","90","","20535.8","1.4","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C100 H136 Ga2 I N4 O7 Tm -","- C100 H136 Ga2 I N4 O7 Tm -","- C800 H1088 Ga16 I8 N32 O56 Tm8 -","8","1","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.1046","0.0467","","","0.0671","0.0746","","","","","","1.006","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078545","45.875","0.007","20.805","0.003","25.246","0.004","90","","122.187","0.002","90","","20392","5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C108 H152 Dy Ga2 I N4 O9 -","- C108 H152 Dy Ga2 I N4 O9 -","- C864 H1216 Dy8 Ga16 I8 N32 O72 -","8","1","","Sanden, Tanja; Gamer, Michael T.; Fagin, Anatoly A.; Chudakova, Valentina A.; Konchenko, Sergey N.; Fedushkin, Igor L.; Roesky, Peter W.","Synthesis of Unsupported Ln‒Ga Bonds by Salt Metathesis and Ga‒Ga Bond Reduction","Organometallics","2012","31","11","4331","","10.1021/om300309b","","","0.71073","MoKα","","0.2018","0.0786","","","0.1247","0.1474","","","","","","0.864","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078546","12.2934","0.0007","32.976","0.0019","17.3876","0.001","90","","107.69","0.001","90","","6715.4","0.7","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cl2 Si Zr -","- C40 H38 Cl2 Si Zr -","- C320 H304 Cl16 Si8 Zr8 -","8","2","","Nifant’ev, Ilya E.; Ivchenko, Pavel V.; Bagrov, Vladimir V.; Churakov, Andrei V.; Chevalier, Reynald","Novel Effective Racemoselective Method for the Synthesis ofansa-Zirconocenes and Its Use for the Preparation ofC2-Symmetric Complexes Based on 2-Methyl-4-aryltetrahydro(s)indacene as Catalysts for Isotactic Propylene Polymerization and Ethylene‒Propylene Copolymerization","Organometallics","2012","31","11","4340","","10.1021/om300311k","","","0.71073","MoKα","","0.0619","0.0403","","","0.0876","0.0949","","","","","","1.018","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078547","18.1387","0.0009","9.1186","0.0005","24.6022","0.0012","90","","95.529","0.001","90","","4050.3","0.4","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H50 Cl3 N Si Zr -","- C45 H50 Cl3 N Si Zr -","- C180 H200 Cl12 N4 Si4 Zr4 -","4","1","","Nifant’ev, Ilya E.; Ivchenko, Pavel V.; Bagrov, Vladimir V.; Churakov, Andrei V.; Chevalier, Reynald","Novel Effective Racemoselective Method for the Synthesis ofansa-Zirconocenes and Its Use for the Preparation ofC2-Symmetric Complexes Based on 2-Methyl-4-aryltetrahydro(s)indacene as Catalysts for Isotactic Propylene Polymerization and Ethylene‒Propylene Copolymerization","Organometallics","2012","31","11","4340","","10.1021/om300311k","","","0.71073","MoKα","","0.0816","0.0531","","","0.1383","0.1497","","","","","","1.076","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078548","11.4554","0.001","12.7418","0.0011","23.037","0.002","98.8679","0.0012","96.8074","0.0012","112.378","0.0011","3013.8","0.5","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C60 H54 Cl4 F3 Ir O6 Os P4 S -","- C58.5 H51 Cl F3 Ir O6 Os P4 S -","- C117 H102 Cl2 F6 Ir2 O12 Os2 P8 S2 -","2","1","","MacDougall, Tiffany J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Diverse Coordination Modes and Transformations of Allenes at Adjacent Iridium/Osmium Centers","Organometallics","2012","31","12","4516","","10.1021/om300316h","","","0.71073","MoKα","","0.0621","0.0452","","","0.0915","0.0971","","","","","","1.048","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078549","12.7514","0.0005","13.2551","0.0005","17.0522","0.0007","79.0395","0.0005","78.3979","0.0004","68.9294","0.0004","2612.54","0.18","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H53 B F4 Ir O3.5 Os P4 -","- C58 H53 B F4 Ir O3.5 Os P4 -","- C116 H106 B2 F8 Ir2 O7 Os2 P8 -","2","1","","MacDougall, Tiffany J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Diverse Coordination Modes and Transformations of Allenes at Adjacent Iridium/Osmium Centers","Organometallics","2012","31","12","4516","","10.1021/om300316h","","","0.71073","MoKα","","0.0434","0.0289","","","0.0539","0.0619","","","","","","1.007","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078550","16.65","0.0005","18.0975","0.0006","19.5586","0.0006","90","","90.0824","0.0004","90","","5893.5","0.3","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C59 H48 Cl2 F5 Ir O7 Os P4 S -","- C59 H48 Cl2 F5 Ir O7 Os P4 S -","- C236 H192 Cl8 F20 Ir4 O28 Os4 P16 S4 -","4","1","","MacDougall, Tiffany J.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Diverse Coordination Modes and Transformations of Allenes at Adjacent Iridium/Osmium Centers","Organometallics","2012","31","12","4516","","10.1021/om300316h","","","0.71073","MoKα","","0.0238","0.0204","","","0.0546","0.0564","","","","","","1.041","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078551","30.592","0.0015","15.388","0.0009","18.693","0.0011","90","","117.843","0.002","90","","7781","0.8","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H48 N2 P -","- C46 H48 N2 P -","- C368 H384 N16 P8 -","8","1","","Bates, Joshua I.; Gates, Derek P.","4-Phosphino-Substituted N-Heterocyclic Carbenes (NHCs) from the Abnormal Reaction of NHCs with Phosphaalkenes","Organometallics","2012","31","12","4529","","10.1021/om3003174","","","0.71069","MoKα","","0.1075","0.0506","","","0.1163","0.1401","","","","","","1.016","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078552","30.427","0.004","14.9796","0.0019","18.825","0.002","90","","117.373","0.005","90","","7619.4","1.6","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H47 N3 P -","- C45 H47 N3 P -","- C360 H376 N24 P8 -","8","1","","Bates, Joshua I.; Gates, Derek P.","4-Phosphino-Substituted N-Heterocyclic Carbenes (NHCs) from the Abnormal Reaction of NHCs with Phosphaalkenes","Organometallics","2012","31","12","4529","","10.1021/om3003174","","","0.71073","MoKα","","0.2112","0.0673","","","0.1232","0.1673","","","","","","0.972","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078553","28.9422","0.0019","15.8054","0.0011","19.7371","0.0013","90","","118.977","0.002","90","","7898.3","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H47 F2 N2 O0.5 P -","- C45 H47 F2 N2 O0.5 P -","- C360 H376 F16 N16 O4 P8 -","8","1","","Bates, Joshua I.; Gates, Derek P.","4-Phosphino-Substituted N-Heterocyclic Carbenes (NHCs) from the Abnormal Reaction of NHCs with Phosphaalkenes","Organometallics","2012","31","12","4529","","10.1021/om3003174","","","0.71069","MoKα","","0.1793","0.0644","","","0.1222","0.1561","","","","","","0.972","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078554","15.9409","0.0013","16.121","0.0012","20.8548","0.0015","89.941","0.004","68.341","0.005","76.55","0.004","4823","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C105 H120 Cl8 Ir2 N4 P2 -","- C105 H120 Cl8 Ir2 N4 P2 -","- C210 H240 Cl16 Ir4 N8 P4 -","2","1","","Bates, Joshua I.; Gates, Derek P.","4-Phosphino-Substituted N-Heterocyclic Carbenes (NHCs) from the Abnormal Reaction of NHCs with Phosphaalkenes","Organometallics","2012","31","12","4529","","10.1021/om3003174","","","0.71073","MoKα","","0.0635","0.0468","","","0.1254","0.1329","","","","","","1.076","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078555","29.1592","0.0009","18.3368","0.0006","17.0683","0.0005","90","","90","","90","","9126.2","0.5","100","2","100","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C52 H53 Cl Ir N2 O2 P -","- C52 H53 Cl Ir N2 O2 P -","- C416 H424 Cl8 Ir8 N16 O16 P8 -","8","1","","Bates, Joshua I.; Gates, Derek P.","4-Phosphino-Substituted N-Heterocyclic Carbenes (NHCs) from the Abnormal Reaction of NHCs with Phosphaalkenes","Organometallics","2012","31","12","4529","","10.1021/om3003174","","","0.71073","MoKα","","0.0392","0.0234","","","0.0465","0.0511","","","","","","1.011","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078556","12.4467","0.0009","18.8488","0.0015","20.7638","0.0016","90","","105.14","0.002","90","","4702.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H74 Fe2 N6 -","- C46 H74 Fe2 N6 -","- C184 H296 Fe8 N24 -","4","1","","Zhang, Qiang; Xiang, Li; Deng, Liang","Dinuclear Iron‒Imido Complexes withN-Heterocyclic Carbene Ligation: Synthesis, Structure, and Redox Reactivity","Organometallics","2012","31","12","4537","","10.1021/om300319n","","","0.71073","MoKα","","0.0884","0.045","","","0.1009","0.1118","","","","","","0.86","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078557","17.8374","0.0015","20.5763","0.0017","25.961","0.002","90","","90","","90","","9528.4","1.3","133","2","133","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C46 H74 F2 Fe2 N6 -","- C46 H74 F2 Fe2 N6 -","- C368 H592 F16 Fe16 N48 -","8","1","","Zhang, Qiang; Xiang, Li; Deng, Liang","Dinuclear Iron‒Imido Complexes withN-Heterocyclic Carbene Ligation: Synthesis, Structure, and Redox Reactivity","Organometallics","2012","31","12","4537","","10.1021/om300319n","","","0.71073","MoKα","","0.0426","0.0333","","","0.0866","0.0944","","","","","","1.047","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078558","23.11","0.005","10.612","0.002","22.47","0.004","90","","107.331","0.003","90","","5260.4","1.8","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C49 H81 B F5 Fe2 N6 -","- C49 H81 B F5 Fe2 N6 -","- C196 H324 B4 F20 Fe8 N24 -","4","1","","Zhang, Qiang; Xiang, Li; Deng, Liang","Dinuclear Iron‒Imido Complexes withN-Heterocyclic Carbene Ligation: Synthesis, Structure, and Redox Reactivity","Organometallics","2012","31","12","4537","","10.1021/om300319n","","","0.71073","MoKα","","0.1158","0.0699","","","0.1748","0.2048","","","","","","0.941","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078559","19.45","0.005","10.598","0.003","25.25","0.007","90","","112.65","","90","","4803","2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H76 Cl2 Fe2 N6 -","- C46 H74 Cl2 Fe2 N6 -","- C184 H296 Cl8 Fe8 N24 -","4","1","","Zhang, Qiang; Xiang, Li; Deng, Liang","Dinuclear Iron‒Imido Complexes withN-Heterocyclic Carbene Ligation: Synthesis, Structure, and Redox Reactivity","Organometallics","2012","31","12","4537","","10.1021/om300319n","","","0.71073","MoKα","","0.0396","0.0313","","","0.0854","0.0937","","","","","","1.071","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078560","9.254","0.0008","20.2564","0.0016","12.4305","0.001","90","","97.286","0.001","90","","2311.3","0.3","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H74 Cl Fe2 N6 -","- C46 H74 Cl Fe2 N6 -","- C92 H148 Cl2 Fe4 N12 -","2","0.5","","Zhang, Qiang; Xiang, Li; Deng, Liang","Dinuclear Iron‒Imido Complexes withN-Heterocyclic Carbene Ligation: Synthesis, Structure, and Redox Reactivity","Organometallics","2012","31","12","4537","","10.1021/om300319n","","","0.71073","MoKα","","0.0877","0.079","","","0.2147","0.2196","","","","","","1.219","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078561","13.87","0.001","10.9081","0.0008","12.6168","0.0009","90","","90","","90","","1908.9","0.2","296","2","296","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C14 H24 B10 Fe -","- C14 H24 B10 Fe -","- C56 H96 B40 Fe4 -","4","0.5","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.0445","0.0379","","","0.1048","0.1154","","","","","","1.057","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078562","11.3004","0.0011","9.4366","0.0009","23.522","0.003","90","","107.771","0.002","90","","2388.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H31 B10 Fe -","- C21 H31 B10 Fe -","- C84 H124 B40 Fe4 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.0761","0.0517","","","0.1342","0.1542","","","","","","1.036","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078563","29.039","0.008","29.62","0.008","8.106","0.002","90","","90","","90","","6972","3","296","2","296","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C12 H19 B10 Cl Fe -","- C12 H19 B10 Cl Fe -","- C192 H304 B160 Cl16 Fe16 -","16","1","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.0395","0.038","","","0.0997","0.1015","","","","","","1.056","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078564","13.809","0.0008","13.5992","0.0008","19.0054","0.001","90","","90","","90","","3569","0.3","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H19 B10 Br Fe -","- C12 H19 B10 Br Fe -","- C96 H152 B80 Br8 Fe8 -","8","1","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.0685","0.0446","","","0.1051","0.1189","","","","","","1.012","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078565","20.2299","0.0016","11.6441","0.0009","7.4979","0.0006","90","","90","","90","","1766.2","0.2","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C13 H22 B10 Fe -","- C13 H22 B10 Fe -","- C52 H88 B40 Fe4 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.0511","0.0418","","","0.0995","0.1058","","","","","","1.065","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078566","15.6213","0.0011","11.1168","0.0008","14.7589","0.001","90","","107.733","0.001","90","","2441.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 B10 Cl Fe2 -","- C22 H26 B10 Cl Fe2 -","- C88 H104 B40 Cl4 Fe8 -","4","1","","Wang, Sunewang Rixin; Xie, Zuowei","Formal Insertion ofo-Carborynes into Ferrocenyl C‒H Bonds: A Simple Access too-Carboranylferrocenes","Organometallics","2012","31","12","4544","","10.1021/om300324n","","","0.71073","MoKα","","0.059","0.0437","","","0.1137","0.1234","","","","","","1.024","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078567","13.1972","0.0007","10.2905","0.0005","21.7022","0.0011","90","","95.0332","0.0011","90","","2935.9","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27.5 H34.5 Cl3 Ir O1.5 P S2 -","- C27.5 H34.5 Cl3 Ir O1.5 P S2 -","- C110 H138 Cl12 Ir4 O6 P4 S8 -","4","1","","Lin, Cheng-Huei; Chiu, Yuan-Chieh; Chi, Yun; Tao, Yu-Tai; Liao, Liang-Sheng; Tseng, Meu-Rurng; Lee, Gene-Hsiang","Mechanistic Investigation of Improved Syntheses of Iridium(III)-Based OLED Phosphors","Organometallics","2012","31","11","4349","","10.1021/om300325y","","","0.71073","MoKα","","0.0372","0.0289","","","0.0701","0.0742","","","","","","1.029","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078568","10.661","0.0008","13.0231","0.001","21.6671","0.0016","90","","90","","90","","3008.2","0.4","150","2","150","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C33 H29 Cl2 F2 Ir N P S -","- C33 H29 Cl2 F2 Ir N P S -","- C132 H116 Cl8 F8 Ir4 N4 P4 S4 -","4","1","","Lin, Cheng-Huei; Chiu, Yuan-Chieh; Chi, Yun; Tao, Yu-Tai; Liao, Liang-Sheng; Tseng, Meu-Rurng; Lee, Gene-Hsiang","Mechanistic Investigation of Improved Syntheses of Iridium(III)-Based OLED Phosphors","Organometallics","2012","31","11","4349","","10.1021/om300325y","","","0.71073","MoKα","","0.0778","0.0671","","","0.1508","0.158","","","","","","1.043","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078569","43.3581","0.0017","8.8949","0.0003","19.2344","0.0007","90","","103.151","0.002","90","","7223.5","0.5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H82 Cl4 Ir2 P4 S2 -","- C84 H82 Cl4 Ir2 P4 S2 -","- C336 H328 Cl16 Ir8 P16 S8 -","4","0.5","","Lin, Cheng-Huei; Chiu, Yuan-Chieh; Chi, Yun; Tao, Yu-Tai; Liao, Liang-Sheng; Tseng, Meu-Rurng; Lee, Gene-Hsiang","Mechanistic Investigation of Improved Syntheses of Iridium(III)-Based OLED Phosphors","Organometallics","2012","31","11","4349","","10.1021/om300325y","","","0.71073","MoKα","","0.0278","0.0245","","","0.055","0.0625","","","","","","1.12","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078570","12.4793","0.0004","20.8875","0.0007","15.9283","0.0005","90","","109.143","0.001","90","","3922.3","0.2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H38 Cl F3 Ir N3 P2 -","- C47 H38 Cl F3 Ir N3 P2 -","- C188 H152 Cl4 F12 Ir4 N12 P8 -","4","1","","Lin, Cheng-Huei; Chiu, Yuan-Chieh; Chi, Yun; Tao, Yu-Tai; Liao, Liang-Sheng; Tseng, Meu-Rurng; Lee, Gene-Hsiang","Mechanistic Investigation of Improved Syntheses of Iridium(III)-Based OLED Phosphors","Organometallics","2012","31","11","4349","","10.1021/om300325y","","","0.71073","MoKα","","0.0352","0.0276","","","0.0568","0.0595","","","","","","1.034","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078571","10.534","0.006","9.49","0.006","13.066","0.008","90","","95.457","0.01","90","","1300.3","1.4","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H37 B Cl2 N2 -","- C27 H37 B Cl2 N2 -","- C54 H74 B2 Cl4 N4 -","2","1","","Xie, Liang; Hu, Hongfan; Cui, Chunming","Cyclopropanation and Isomerization Reactions of β-Diketiminato Boron Complexes","Organometallics","2012","31","12","4405","","10.1021/om300337r","","","0.71073","MoKα","","0.0537","0.0394","","","0.0776","0.0802","","","","","","0.83","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078572","8.85","0.003","11.175","0.004","13.294","0.005","95.356","0.009","91.103","0.005","101.179","0.006","1283.2","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H37 B Cl2 N2 -","- C27 H37 B Cl2 N2 -","- C54 H74 B2 Cl4 N4 -","2","1","","Xie, Liang; Hu, Hongfan; Cui, Chunming","Cyclopropanation and Isomerization Reactions of β-Diketiminato Boron Complexes","Organometallics","2012","31","12","4405","","10.1021/om300337r","","","0.71073","MoKα","","0.0522","0.0369","","","0.0859","0.0909","","","","","","0.982","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078573","13.048","0.004","9.249","0.003","20.362","0.006","90","","90","","90","","2457.3","1.3","113","2","113","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C27 H36 B Cl N2 -","- C27 H36 B Cl N2 -","- C108 H144 B4 Cl4 N8 -","4","0.5","","Xie, Liang; Hu, Hongfan; Cui, Chunming","Cyclopropanation and Isomerization Reactions of β-Diketiminato Boron Complexes","Organometallics","2012","31","12","4405","","10.1021/om300337r","","","0.71073","MoKα","","0.0905","0.0874","","","0.1613","0.1625","","","","","","1.234","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078574","10.799","0.004","17.115","0.006","18.214","0.007","90","","99.525","0.005","90","","3320","2","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H54 B N3 Si2 -","- C33 H54 B N3 Si2 -","- C132 H216 B4 N12 Si8 -","4","1","","Xie, Liang; Hu, Hongfan; Cui, Chunming","Cyclopropanation and Isomerization Reactions of β-Diketiminato Boron Complexes","Organometallics","2012","31","12","4405","","10.1021/om300337r","","","0.71073","MoKα","","0.1057","0.0697","","","0.1537","0.1738","","","","","","1.146","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078575","8.828","0.003","41.132","0.013","8.417","0.003","90","","106.977","0.004","90","","2923.1","1.7","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H47 B Cl N3 -","- C31 H47 B Cl N3 -","- C124 H188 B4 Cl4 N12 -","4","1","","Xie, Liang; Hu, Hongfan; Cui, Chunming","Cyclopropanation and Isomerization Reactions of β-Diketiminato Boron Complexes","Organometallics","2012","31","12","4405","","10.1021/om300337r","","","0.71073","MoKα","","0.0546","0.0436","","","0.1013","0.1068","","","","","","1.046","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078576","13.1907","0.0007","12.8417","0.0007","14.1613","0.0008","90","","99.119","0.001","90","","2368.5","0.2","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C42 H49 Cl2 F12 Ir O P2 Sb2 -","- C42 H49 Cl2 F12 Ir O P2 Sb2 -","- C84 H98 Cl4 F24 Ir2 O2 P4 Sb4 -","2","1","","Carmona, Daniel; Viguri, Fernando; Asenjo, Ainara; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.","Enantioselective Catalytic Diels‒Alder Reactions with Enones As Dienophiles","Organometallics","2012","31","12","4551","","10.1021/om300346s","","","0.71073","MoKα","","0.0233","0.023","","","0.0592","0.0594","","","","","","1.037","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078577","13.132","0.004","13.166","0.004","14.039","0.005","90","","96.429","0.005","90","","2412","1.3","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C43 H51 Cl2 F12 Ir O P2 Sb2 -","- C43 H51 Cl2 F12 Ir O P2 Sb2 -","- C86 H102 Cl4 F24 Ir2 O2 P4 Sb4 -","2","1","","Carmona, Daniel; Viguri, Fernando; Asenjo, Ainara; Lahoz, Fernando J.; García-Orduña, Pilar; Oro, Luis A.","Enantioselective Catalytic Diels‒Alder Reactions with Enones As Dienophiles","Organometallics","2012","31","12","4551","","10.1021/om300346s","","","0.71073","MoKα","","0.1221","0.0733","","","0.1537","0.1758","","","","","","1.049","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078578","30.301","0.0011","8.902","0.0004","15.8361","0.0004","90","","90","","90","","4271.6","0.3","150","2","150","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C22 H28 Au Cl N2 -","- C22 H28 Au Cl N2 -","- C176 H224 Au8 Cl8 N16 -","8","1","","Dunsford, Jay J.; Cavell, Kingsley J.; Kariuki, Benson M.","Gold(I) Complexes Bearing Sterically Imposing, Saturated Six- and Seven-Membered Expanded Ring N-Heterocyclic Carbene Ligands","Organometallics","2012","31","11","4118","","10.1021/om300351s","","","0.71073","MoKα","","0.0847","0.0582","","","0.1068","0.1169","","","","","","1.102","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078579","10.7004","0.0003","16.5866","0.0004","17.7255","0.0004","90","","90","","90","","3145.98","0.14","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H41 Au Cl4 N2 -","- C29 H41 Au Cl4 N2 -","- C116 H164 Au4 Cl16 N8 -","4","1","","Dunsford, Jay J.; Cavell, Kingsley J.; Kariuki, Benson M.","Gold(I) Complexes Bearing Sterically Imposing, Saturated Six- and Seven-Membered Expanded Ring N-Heterocyclic Carbene Ligands","Organometallics","2012","31","11","4118","","10.1021/om300351s","","","0.71073","MoKα","","0.0593","0.0463","","","0.0985","0.1068","","","","","","1.003","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078580","9.4715","0.0002","16.9868","0.0005","20.2919","0.0005","90","","94.594","0.002","90","","3254.28","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H43 Au Cl4 N2 -","- C30 H43 Au Cl4 N2 -","- C120 H172 Au4 Cl16 N8 -","4","1","","Dunsford, Jay J.; Cavell, Kingsley J.; Kariuki, Benson M.","Gold(I) Complexes Bearing Sterically Imposing, Saturated Six- and Seven-Membered Expanded Ring N-Heterocyclic Carbene Ligands","Organometallics","2012","31","11","4118","","10.1021/om300351s","","","0.71073","MoKα","","0.0671","0.0454","","","0.1016","0.1117","","","","","","1.054","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078581","14.2884","0.0011","11.9763","0.0011","31.944","0.003","90","","101.585","0.002","90","","5355","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H48 Br4 Cl9 N7 Pd2 -","- C34 H48 Br4 Cl9 N7 Pd2 -","- C136 H192 Br16 Cl36 N28 Pd8 -","4","1","","Guo, Shuai; Huynh, Han Vinh","Dipalladium Complexes with Triazolidin-Diylidene Bridges and Their Catalytic Activities","Organometallics","2012","31","12","4565","","10.1021/om3003625","","","0.71073","MoKα","","0.1176","0.0635","","","0.1493","0.1706","","","","","","1.031","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078582","9.1677","0.0006","15.6062","0.0009","31.6509","0.0017","90","","90","","90","","4528.4","0.5","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C39 H57 N7 O8 Pd2 -","- C39 H57 N7 O8 Pd2 -","- C156 H228 N28 O32 Pd8 -","4","1","","Guo, Shuai; Huynh, Han Vinh","Dipalladium Complexes with Triazolidin-Diylidene Bridges and Their Catalytic Activities","Organometallics","2012","31","12","4565","","10.1021/om3003625","","","0.71073","MoKα","","0.1135","0.0909","","","0.2202","0.2352","","","","","","1.108","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078583","14.4073","0.0017","26.565","0.003","13.7018","0.0017","90","","104.89","0.003","90","","5068","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H48 F12 N8 O8 Pd2 -","- C41 H48 F12 N8 O8 Pd2 -","- C164 H192 F48 N32 O32 Pd8 -","4","1","","Guo, Shuai; Huynh, Han Vinh","Dipalladium Complexes with Triazolidin-Diylidene Bridges and Their Catalytic Activities","Organometallics","2012","31","12","4565","","10.1021/om3003625","","","0.71073","MoKα","","0.1131","0.0882","","","0.2222","0.2418","","","","","","1.039","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078584","16.9882","0.0009","9.9514","0.0005","18.5623","0.001","90","","90","","90","","3138.1","0.3","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C30 H42 N4 O4 Pd -","- C30 H42 N4 O4 Pd -","- C120 H168 N16 O16 Pd4 -","4","0.5","","Guo, Shuai; Huynh, Han Vinh","Dipalladium Complexes with Triazolidin-Diylidene Bridges and Their Catalytic Activities","Organometallics","2012","31","12","4565","","10.1021/om3003625","","","0.71073","MoKα","","0.0784","0.0465","","","0.0949","0.1062","","","","","","1.047","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078585","13.419","0.003","15.713","0.003","20.572","0.004","90","","101.572","0.003","90","","4249.5","1.5","133","2","133","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H62 N4 O P Y -","- C45 H62 N4 O P Y -","- C180 H248 N16 O4 P4 Y4 -","4","1","","Lu, Erli; Chen, Yaofeng; Zhou, Jiliang; Leng, Xuebing","C–P or C–H Bond Cleavage of Phosphine Oxides Mediated by an Yttrium Hydride","Organometallics","2012","31","12","4574","","10.1021/om300369f","","","0.71073","MoKα","","0.1075","0.0618","","","0.1319","0.1508","","","","","","1.004","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078586","11.2506","0.0013","19.462","0.002","17.509","0.002","90","","91.841","0.002","90","","3831.8","0.7","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H60 N4 O P Y -","- C36 H60 N4 O P Y -","- C144 H240 N16 O4 P4 Y4 -","4","1","","Lu, Erli; Chen, Yaofeng; Zhou, Jiliang; Leng, Xuebing","C‒P or C‒H Bond Cleavage of Phosphine Oxides Mediated by an Yttrium Hydride","Organometallics","2012","31","12","4574","","10.1021/om300369f","","","0.71073","MoKα","","0.0691","0.0369","","","0.0859","0.0967","","","","","","0.994","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078587","11.3048","0.0016","19.869","0.003","20.007","0.003","90","","102.581","0.002","90","","4386","1.1","133","2","133","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H64 N4 O P Y -","- C46 H64 N4 O P Y -","- C184 H256 N16 O4 P4 Y4 -","4","1","","Lu, Erli; Chen, Yaofeng; Zhou, Jiliang; Leng, Xuebing","C‒P or C‒H Bond Cleavage of Phosphine Oxides Mediated by an Yttrium Hydride","Organometallics","2012","31","12","4574","","10.1021/om300369f","","","0.71073","MoKα","","0.1225","0.0675","","","0.151","0.1772","","","","","","1.011","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078588","19.4796","0.0015","21.5546","0.0016","21.3164","0.0016","90","","108.925","0.001","90","","8466.4","1.1","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C86 H134 N8 S Y2 -","- C86 H134 N8 S Y2 -","- C344 H536 N32 S4 Y8 -","4","1","","Lu, Erli; Chen, Yaofeng; Zhou, Jiliang; Leng, Xuebing","C‒P or C‒H Bond Cleavage of Phosphine Oxides Mediated by an Yttrium Hydride","Organometallics","2012","31","12","4574","","10.1021/om300369f","","","0.71073","MoKα","","0.117","0.0576","","","0.1229","0.1453","","","","","","0.972","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078589","12.5027","0.0012","19.0274","0.0017","20.993","0.002","102.59","0.001","106.981","0.002","99.907","0.002","4510.4","0.7","185","2","185","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H67 N3 O0 P Si2 Y -","- C44 H67 N3 P Si2 Y -","- C176 H268 N12 P4 Si8 Y4 -","4","2","","Jian, Zhongbao; Hangaly, Noa K.; Rong, Weifeng; Mou, Zehuai; Liu, Dongtao; Li, Shihui; Trifonov, Alexander A.; Sundermeyer, Jörg; Cui, Dongmei","Yttrium Hydride Complex Bearing CpPN/Amidinate Heteroleptic Ligands: Synthesis, Structure, and Reactivity","Organometallics","2012","31","12","4579","","10.1021/om3003703","","","0.71073","MoKα","","0.155","0.0697","","","0.1505","0.1878","","","","","","1.033","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078590","17.814","0.002","19.028","0.003","19.232","0.004","109.194","0.003","111.367","0.003","105.884","0.002","5127.6","1.5","185","2","185","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H114 N6 P2 Si2 Y2 -","- C80 H114 N6 P2 Si2 Y2 -","- C160 H228 N12 P4 Si4 Y4 -","2","1","","Jian, Zhongbao; Hangaly, Noa K.; Rong, Weifeng; Mou, Zehuai; Liu, Dongtao; Li, Shihui; Trifonov, Alexander A.; Sundermeyer, Jörg; Cui, Dongmei","Yttrium Hydride Complex Bearing CpPN/Amidinate Heteroleptic Ligands: Synthesis, Structure, and Reactivity","Organometallics","2012","31","12","4579","","10.1021/om3003703","","","0.71073","MoKα","","0.1464","0.0662","","","0.151","0.1631","","","","","","1.008","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078591","10.9296","0.0009","13.5103","0.0011","22.4318","0.0017","72.644","0.001","86.368","0.002","68.547","0.001","2938.6","0.4","185","2","185","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H77 N7 P Si Y -","- C64 H77 N7 P Si Y -","- C128 H154 N14 P2 Si2 Y2 -","2","1","","Jian, Zhongbao; Hangaly, Noa K.; Rong, Weifeng; Mou, Zehuai; Liu, Dongtao; Li, Shihui; Trifonov, Alexander A.; Sundermeyer, Jörg; Cui, Dongmei","Yttrium Hydride Complex Bearing CpPN/Amidinate Heteroleptic Ligands: Synthesis, Structure, and Reactivity","Organometallics","2012","31","12","4579","","10.1021/om3003703","","","0.71073","MoKα","","0.107","0.058","","","0.1132","0.1303","","","","","","1.019","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078592","12.1425","0.0005","24.8422","0.001","15.711","0.0006","90","","96.511","0.001","90","","4708.6","0.3","185","2","185","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47 H71 N5 P Si Y -","- C47 H71 N5 P Si Y -","- C188 H284 N20 P4 Si4 Y4 -","4","1","","Jian, Zhongbao; Hangaly, Noa K.; Rong, Weifeng; Mou, Zehuai; Liu, Dongtao; Li, Shihui; Trifonov, Alexander A.; Sundermeyer, Jörg; Cui, Dongmei","Yttrium Hydride Complex Bearing CpPN/Amidinate Heteroleptic Ligands: Synthesis, Structure, and Reactivity","Organometallics","2012","31","12","4579","","10.1021/om3003703","","","0.71073","MoKα","","0.0864","0.0455","","","0.0856","0.098","","","","","","0.987","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078593","16.6515","0.0018","17.2291","0.0019","19.625","0.002","90","","106.901","0.002","90","","5387","1","185","2","185","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H77 N7 P Si Y -","- C54 H77 N7 P Si Y -","- C216 H308 N28 P4 Si4 Y4 -","4","1","","Jian, Zhongbao; Hangaly, Noa K.; Rong, Weifeng; Mou, Zehuai; Liu, Dongtao; Li, Shihui; Trifonov, Alexander A.; Sundermeyer, Jörg; Cui, Dongmei","Yttrium Hydride Complex Bearing CpPN/Amidinate Heteroleptic Ligands: Synthesis, Structure, and Reactivity","Organometallics","2012","31","12","4579","","10.1021/om3003703","","","0.71073","MoKα","","0.1547","0.0716","","","0.1703","0.2019","","","","","","1.024","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078594","13.277","0.004","13.065","0.003","20.035","0.005","90","","128.322","0.017","90","","2726.5","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 Cl4 N2 Pt -","- C26 H30 Cl4 N2 Pt -","- C104 H120 Cl16 N8 Pt4 -","4","1","","Calvet, Teresa; Crespo, Margarita; Font-Bardía, Mercè; Jansat, Susanna; Martínez, Manuel","Kinetico-Mechanistic Studies on Intramolecular C‒X Bond Activation (X = Br, Cl) of Amino-Imino Ligands on Pt(II) Compounds. Prevalence of a Concerted Mechanism in Nonpolar, Polar, and Ionic Liquid Media","Organometallics","2012","31","11","4367","","10.1021/om300374f","","","0.71073","MoKα","","0.0359","0.033","","","0.0903","0.0939","","","","","","1.068","","","","has coordinates,has disorder","178674","2020-10-21","18:00:00",""
"4078595","8.384","0.003","9.073","0.003","17.254","0.004","89.19","0.01","86.06","0.02","72.47","0.01","1248.5","0.7","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H33 N2 P Si -","- C27 H33 N2 P Si -","- C54 H66 N4 P2 Si2 -","2","1","","Azhakar, Ramachandran; Ghadwal, Rajendra S.; Roesky, Herbert W.; Wolf, Hilke; Stalke, Dietmar","Facile Access to the Functionalized N-Donor Stabilized Silylenes PhC(NtBu)2SiX (X = PPh2, NPh2, NCy2, NiPr2, NMe2, N(SiMe3)2, OtBu)","Organometallics","2012","31","12","4588","","10.1021/om3003762","","","0.71073","MoKα","","0.0333","0.0311","","","0.0828","0.0841","","","","","","1.061","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078596","15.04","0.004","11.542","0.004","16.516","0.006","90","","111.7","0.02","90","","2663.9","1.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H45 N3 Si -","- C27 H45 N3 Si -","- C108 H180 N12 Si4 -","4","1","","Azhakar, Ramachandran; Ghadwal, Rajendra S.; Roesky, Herbert W.; Wolf, Hilke; Stalke, Dietmar","Facile Access to the Functionalized N-Donor Stabilized Silylenes PhC(NtBu)2SiX (X = PPh2, NPh2, NCy2, NiPr2, NMe2, N(SiMe3)2, OtBu)","Organometallics","2012","31","12","4588","","10.1021/om3003762","","","0.71073","MoKα","","0.0493","0.0379","","","0.0876","0.0921","","","","","","1.043","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078597","27.82","0.002","8.447","0.003","19.099","0.002","90","","99.35","0.02","90","","4428.6","1.7","101","2","101","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H37 N3 Si -","- C21 H37 N3 Si -","- C168 H296 N24 Si8 -","8","1","","Azhakar, Ramachandran; Ghadwal, Rajendra S.; Roesky, Herbert W.; Wolf, Hilke; Stalke, Dietmar","Facile Access to the Functionalized N-Donor Stabilized Silylenes PhC(NtBu)2SiX (X = PPh2, NPh2, NCy2, NiPr2, NMe2, N(SiMe3)2, OtBu)","Organometallics","2012","31","12","4588","","10.1021/om3003762","","","0.71073","MoKα","","0.0621","0.0416","","","0.0936","0.1002","","","","","","1.047","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078598","18.8621","0.0004","13.8228","0.0003","18.8523","0.0005","90","","113.389","0.003","90","","4511.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C84 H100 Cl14 N4 Rh2 -","- C84 H100 Cl14 N4 Rh2 -","- C168 H200 Cl28 N8 Rh4 -","2","0.5","","Prades, Amparo; Peris, Eduardo; Alcarazo, Manuel","Pyracenebis(imidazolylidene): A New Janus-Type Biscarbene and Its Coordination to Rhodium and Iridium","Organometallics","2012","31","12","4623","","10.1021/om3003834","","","0.71073","MoKα","","0.1127","0.0619","","","0.142","0.176","","","","","","1.06","","","","has coordinates","178674","2020-10-21","18:00:00",""
"4078599","13.1929","0.0013","17.5573","0.0018","19.868","0.002","90","","105.178","0.001","90","","4441.5","0.8","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C54 H46 Ge4 -","- C54 H46 Ge4 -","- C216 H184 Ge16 -","4","1","","Samanamu, Christian R.; Amadoruge, Monika L.; Schrick, Aaron C.; Chen, Chao; Golen, James A.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S.","Synthetic, Structural, and Physical Investigations of the Large Linear and Branched Oligogermanes Ph3GeGePh2GePh2GePh2H, Ge5Ph12, and (Ph3Ge)4Ge","Organometallics","2012","31","11","4374","","10.1021/om300385n","","","0.71073","MoKα","","0.054","0.034","","","0.0748","0.0841","","","","","","1.002","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078600","14.3026","0.0012","19.1586","0.0017","21.3983","0.0018","90","","90","","90","","5863.5","0.9","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C72 H60 Ge5 -","- C72 H60 Ge5 -","- C288 H240 Ge20 -","4","1","","Samanamu, Christian R.; Amadoruge, Monika L.; Schrick, Aaron C.; Chen, Chao; Golen, James A.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S.","Synthetic, Structural, and Physical Investigations of the Large Linear and Branched Oligogermanes Ph3GeGePh2GePh2GePh2H, Ge5Ph12, and (Ph3Ge)4Ge","Organometallics","2012","31","11","4374","","10.1021/om300385n","","","0.71073","MoKα","","0.035","0.032","","","0.0847","0.0861","","","","","","1.06","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078601","13.321","0.0006","49.968","0.002","18.4106","0.0008","90","","90.028","0.002","90","","12254.5","0.9","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C150 H134 Ge10 -","- C150 H134 Ge10 -","- C600 H536 Ge40 -","4","1","","Samanamu, Christian R.; Amadoruge, Monika L.; Schrick, Aaron C.; Chen, Chao; Golen, James A.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S.","Synthetic, Structural, and Physical Investigations of the Large Linear and Branched Oligogermanes Ph3GeGePh2GePh2GePh2H, Ge5Ph12, and (Ph3Ge)4Ge","Organometallics","2012","31","11","4374","","10.1021/om300385n","","","0.71073","MoKα","","0.0801","0.0482","","","0.1068","0.1256","","","","","","1.033","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078602","9.4123","0.0019","9.4402","0.0019","9.779","0.002","92.021","0.003","108.696","0.003","98.341","0.003","811.2","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H17 Ge N -","- C20 H17 Ge N -","- C40 H34 Ge2 N2 -","2","1","","Samanamu, Christian R.; Amadoruge, Monika L.; Schrick, Aaron C.; Chen, Chao; Golen, James A.; Rheingold, Arnold L.; Materer, Nicholas F.; Weinert, Charles S.","Synthetic, Structural, and Physical Investigations of the Large Linear and Branched Oligogermanes Ph3GeGePh2GePh2GePh2H, Ge5Ph12, and (Ph3Ge)4Ge","Organometallics","2012","31","11","4374","","10.1021/om300385n","","","0.71073","MoKα","","0.0831","0.0545","","","0.1102","0.1249","","","","","","1","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078603","18.233","0.002","21.495","0.003","24.119","0.003","90","","90","","90","","9453","2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C74 H80 Co6 N4 Ni22 O36 -","- C74 H80 Co6 N4 Ni22 O36 -","- C296 H320 Co24 N16 Ni88 O144 -","4","0.5","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.068","0.042","","","0.0991","0.1171","","","","","","1.075","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078604","14.578","0.003","14.582","0.003","15.213","0.004","62.964","0.003","63.929","0.003","87.386","0.003","2538.9","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H84 Co6 N10 Ni22 O36 -","- C74 H84 Co6 N10 Ni22 O36 -","- C74 H84 Co6 N10 Ni22 O36 -","1","0.5","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.1151","0.0885","","","0.2461","0.2653","","","","","","1.061","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078605","12.0473","0.0012","12.2173","0.0012","18.4801","0.0018","90","","90","","90","","2720","0.5","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C41.42 H60 Co N3 Ni9 O15.42 -","- C41.42 H60 Co N3 Ni9 O15.42 -","- C82.84 H120 Co2 N6 Ni18 O30.84 -","2","0.25","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.0442","0.0407","","","0.1011","0.1027","","","","","","1.225","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078606","11.997","0.0011","12.2347","0.0011","18.442","0.0017","90","","90","","90","","2706.9","0.4","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C41.29 H60 Co N3 Ni9 O15.3 -","- C41.282 H61 Co N3 Ni9 O15.282 -","- C82.564 H122 Co2 N6 Ni18 O30.564 -","2","0.25","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.0409","0.033","","","0.0859","0.0917","","","","","","1.091","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078607","11.996","0.0016","12.2702","0.0016","18.406","0.002","90","","90","","90","","2709.2","0.6","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C41.17 H60 Co N3 Ni9 O15.16 -","- C41.182 H60 Co N3 Ni9 O15.182 -","- C82.364 H120 Co2 N6 Ni18 O30.364 -","2","0.25","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.0496","0.0458","","","0.1276","0.1309","","","","","","1.179","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078608","11.9946","0.0013","12.2638","0.0014","18.415","0.002","90","","90","","90","","2708.8","0.5","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C41.19 H60 Co N3 Ni9 O15.18 -","- C41.176 H60 Co N3 Ni9 O15.176 -","- C82.352 H120 Co2 N6 Ni18 O30.352 -","2","0.25","","Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano","Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1)","Organometallics","2012","31","12","4593","","10.1021/om300412d","","","0.71073","MoKα","","0.0631","0.0512","","","0.1429","0.1502","","","","","","1.156","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078609","8.1706","0.0005","12.2862","0.0007","23.6896","0.0012","90","","90","","90","","2378.1","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 N O3 S -","- C25 H33 N O3 S -","- C100 H132 N4 O12 S4 -","4","1","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.0558","0.0489","","","0.122","0.1265","","","","","","1.039","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078610","12.2812","0.0012","13.3467","0.0014","15.9608","0.0017","77.98","0.002","74.061","0.002","89.87","0.003","2456.3","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H30 Br N O3 S -","- C24 H30 Br N O3 S -","- C96 H120 Br4 N4 O12 S4 -","4","2","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.1162","0.0674","","","0.1832","0.202","","","","","","1.014","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078611","9.1187","0.0007","20.3918","0.0015","23.2891","0.0018","90","","90","","90","","4330.5","0.6","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H29 N O3 S -","- C22 H29 N O3 S -","- C176 H232 N8 O24 S8 -","8","1","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.0829","0.0567","","","0.129","0.1404","","","","","","1.074","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078612","19.2333","0.0013","8.4368","0.0006","12.4042","0.0008","90","","96.411","0.002","90","","2000.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 N O4 S -","- C21 H27 N O4 S -","- C84 H108 N4 O16 S4 -","4","1","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.0787","0.0541","","","0.1354","0.1502","","","","","","1.036","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078613","14.689","0.003","9.005","0.002","32.942","0.008","90","","90","","90","","4357.4","1.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H31 N O3 S -","- C23 H31 N O3 S -","- C184 H248 N8 O24 S8 -","8","1","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.0782","0.0493","","","0.118","0.1339","","","","","","1.047","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078614","8.5624","0.0012","8.6068","0.0012","13.3479","0.0019","91.113","0.002","98.047","0.002","95.389","0.002","969.2","0.2","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 N O3 S -","- C21 H27 N O3 S -","- C42 H54 N2 O6 S2 -","2","1","","Lu, Bei-Li; Wei, Yin; Shi, Min","Rhodium(I)-Catalyzed Pauson–Khand-type [3 + 2 + 1] Cycloaddition Reaction of Ene-Vinylidenecyclopropanes and CO: A Highly Regio- and Stereoselective Synthetic Approach for the Preparation of Aza- and Oxa-Bicyclic Compounds","Organometallics","2012","31","12","4601","","10.1021/om3004288","","","0.71073","MoKα","","0.0573","0.0428","","","0.1305","0.1616","","","","","","1.102","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078615","7.996","0.004","23.664","0.011","9.514","0.005","90","","113.75","0.005","90","","1647.8","1.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Fe0 Mn N O5 -","- C16 H16 Mn N O5 -","- C64 H64 Mn4 N4 O20 -","4","1","","Patra, Malay; Gasser, Gilles; Wenzel, Michaela; Merz, Klaus; Bandow, Julia E.; Metzler-Nolte, Nils","Sandwich and Half-Sandwich Derivatives of Platensimycin: Synthesis and Biological Evaluation","Organometallics","2012","31","16","5760","","10.1021/om201146c","","","0.71075","MoKα","","0.0686","0.046","","","0.0973","0.1103","","","","","","1.114","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078616","21.472","0.01","7.707","0.003","30.064","0.014","90","","90","","90","","4975","4","203","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H24 Mn N O11 -","- C24 H24 Mn N O11 -","- C192 H192 Mn8 N8 O88 -","8","1","","Patra, Malay; Gasser, Gilles; Wenzel, Michaela; Merz, Klaus; Bandow, Julia E.; Metzler-Nolte, Nils","Sandwich and Half-Sandwich Derivatives of Platensimycin: Synthesis and Biological Evaluation","Organometallics","2012","31","16","5760","","10.1021/om201146c","","","0.71073","MoKα","","0.0766","0.0616","","","0.1584","0.1758","","","","","","1.055","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078617","30.07","0.04","7.5683","0.001","13.092","0.018","90","","102.27","0.016","90","","2911","6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H35 Fe N O6 Si -","- C29 H35 Fe N O6 Si -","- C116 H140 Fe4 N4 O24 Si4 -","4","1","","Patra, Malay; Gasser, Gilles; Wenzel, Michaela; Merz, Klaus; Bandow, Julia E.; Metzler-Nolte, Nils","Sandwich and Half-Sandwich Derivatives of Platensimycin: Synthesis and Biological Evaluation","Organometallics","2012","31","16","5760","","10.1021/om201146c","","","0.71075","MoKα","","0.1099","0.0842","","","0.2001","0.2181","","","","","","1.04","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078618","7.727","0.011","9.545","0.015","16.53","0.03","82.1","0.04","86.75","0.05","67.37","0.04","1115","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H20 Mn N O9 -","- C23 H20 Mn N O9 -","- C46 H40 Mn2 N2 O18 -","2","1","","Patra, Malay; Gasser, Gilles; Wenzel, Michaela; Merz, Klaus; Bandow, Julia E.; Metzler-Nolte, Nils","Sandwich and Half-Sandwich Derivatives of Platensimycin: Synthesis and Biological Evaluation","Organometallics","2012","31","16","5760","","10.1021/om201146c","","","0.71075","MoKα","","0.2148","0.0905","","","0.1341","0.1839","","","","","","1.037","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078619","9.6598","0.0014","16.151","0.003","17.149","0.003","65.55","0.002","88.613","0.003","78.037","0.003","2377","0.7","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H70 Li2 N4 O4 -","- C52 H70 Li2 N4 O4 -","- C104 H140 Li4 N8 O8 -","2","1","","Zhang, Yanyu; Yao, Wei; Li, He; Mu, Ying","Rare-Earth-Metal Complexes Supported by New Chiral Tetra-Azane Chelating Ligands: Synthesis, Characterization, and Catalytic Properties for Intramolecular Asymmetric Hydroamination","Organometallics","2012","31","13","4670","","10.1021/om201286u","","","0.71073","MoKα","","0.163","0.079","","","0.1601","0.2017","","","","","","1.011","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078620","12.6508","0.0009","17.935","0.0012","22.2951","0.0015","90","","90","","90","","5058.6","0.6","203","2","203","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C52 H70 Cl2 Li N4 O4 Sc -","- C52 H70 Cl2 Li N4 O4 Sc -","- C208 H280 Cl8 Li4 N16 O16 Sc4 -","4","1","","Zhang, Yanyu; Yao, Wei; Li, He; Mu, Ying","Rare-Earth-Metal Complexes Supported by New Chiral Tetra-Azane Chelating Ligands: Synthesis, Characterization, and Catalytic Properties for Intramolecular Asymmetric Hydroamination","Organometallics","2012","31","13","4670","","10.1021/om201286u","","","0.71073","MoKα","","0.0548","0.0466","","","0.1178","0.1226","","","","","","1.119","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078621","12.3497","0.0016","18.816","0.003","22.036","0.003","90","","90","","90","","5120.5","1.3","203","2","203","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C52 H70 Cl2 Li N4 O4 Y -","- C52 H70 Cl2 Li N4 O4 Y -","- C208 H280 Cl8 Li4 N16 O16 Y4 -","4","1","","Zhang, Yanyu; Yao, Wei; Li, He; Mu, Ying","Rare-Earth-Metal Complexes Supported by New Chiral Tetra-Azane Chelating Ligands: Synthesis, Characterization, and Catalytic Properties for Intramolecular Asymmetric Hydroamination","Organometallics","2012","31","13","4670","","10.1021/om201286u","","","0.71073","MoKα","","0.1862","0.0741","","","0.1063","0.1346","","","","","","0.945","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078622","13.2799","0.0009","13.9219","0.0009","27.5159","0.0018","90","","90","","90","","5087.2","0.6","203","2","203","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C52 H70 Cl2 Li N4 O2 Y -","- C52 H70 Cl2 Li N4 O2 Y -","- C208 H280 Cl8 Li4 N16 O8 Y4 -","4","1","","Zhang, Yanyu; Yao, Wei; Li, He; Mu, Ying","Rare-Earth-Metal Complexes Supported by New Chiral Tetra-Azane Chelating Ligands: Synthesis, Characterization, and Catalytic Properties for Intramolecular Asymmetric Hydroamination","Organometallics","2012","31","13","4670","","10.1021/om201286u","","","0.71073","MoKα","","0.115","0.0997","","","0.263","0.2778","","","","","","1.064","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078623","10.3898","0.0011","16.0613","0.0019","34.037","0.004","90","","90","","90","","5679.9","1.1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C36 H28 O P2 S -","- C36 H28 O P2 S -","- C288 H224 O8 P16 S8 -","8","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.054","0.0421","","","0.105","0.1137","","","","","","1.071","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078624","16.9653","0.0017","10.9952","0.0011","24.222","0.002","90","","108.588","0.002","90","","4282.6","0.7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H60 Cl O4 P2 Rh S -","- C48 H36 Cl O4 P2 Rh S -","- C192 H144 Cl4 O16 P8 Rh4 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.065","0.0471","","","0.12","0.1335","","","","","","1.048","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078625","12.0674","0.0004","12.7353","0.0004","19.5111","0.0006","90","","90","","90","","2998.5","0.17","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H28 N3 O P2 Rh S -","- C36 H28 N3 O P2 Rh S -","- C144 H112 N12 O4 P8 Rh4 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0329","0.0267","","","0.0527","0.0551","","","","","","1.031","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078626","33.188","0.002","12.5088","0.0007","27.1062","0.0016","90","","125.157","0.002","90","","9200.1","1","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48.5 H43 F6 N O P3 Rh S -","- C48.5 H43 F6 N O P3 Rh S -","- C388 H344 F48 N8 O8 P24 Rh8 S8 -","8","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0586","0.0356","","","0.0787","0.0888","","","","","","1.024","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078627","10.8356","0.0009","14.2555","0.0012","17.2755","0.0014","67.974","0.001","87.434","0.001","67.813","0.001","2275.9","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H58 Cl Ir O3 P2 S -","- C52 H58 Cl Ir O3 P2 S -","- C104 H116 Cl2 Ir2 O6 P4 S2 -","2","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0526","0.0392","","","0.085","0.0917","","","","","","1.033","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078628","9.9455","0.0004","13.7424","0.0005","15.618","0.0006","90","","94.95","0.002","90","","2126.63","0.14","100","2","100","2","","","","","","","","9","P 1 c 1","P -2yc","7","","","","- C41 H34 Cl F3 Ir N2 O4 P2 S2 -","- C41 H34 Cl F3 Ir N2 O4 P2 S2 -","- C82 H68 Cl2 F6 Ir2 N4 O8 P4 S4 -","2","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","1.54178","CuKα","","0","0.0202","","","0.0504","0.0505","","","","","","1.068","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078629","10.1433","0.0003","10.4097","0.0003","17.6886","0.0004","94.6","","92.44","","113.23","","1705.15","0.08","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H36 Cl Ir O2 P2 S -","- C40 H36 Cl Ir O2 P2 S -","- C80 H72 Cl2 Ir2 O4 P4 S2 -","2","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0211","0.0195","","","0.0466","0.0473","","","","","","1.03","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078630","17.1826","0.0012","9.3648","0.0007","19.5299","0.0014","90","","104.127","0.002","90","","3047.5","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 Cl Ir O3 P2 S -","- C36 H28 Cl Ir O3 P2 S -","- C144 H112 Cl4 Ir4 O12 P8 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0484","0.032","","","0.0688","0.0747","","","","","","1.032","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078631","10.1778","0.0005","18.3139","0.0009","18.2294","0.0009","90","","104.693","0.003","90","","3286.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H28 Ni O2.5 P2 S -","- C39 H28 Ni O2.5 P2 S -","- C156 H112 Ni4 O10 P8 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0805","0.0741","","","0.1778","0.1807","","","","","","1.326","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078632","13.3638","0.0002","15.4106","0.0002","18.3533","0.0002","90","","106.051","0.001","90","","3632.41","0.08","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C39 H31 Cl F6 Ni O P3 S -","- C39 H31 Cl F6 Ni O P3 S -","- C156 H124 Cl4 F24 Ni4 O4 P12 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","1.54178","CuKα","","0.0368","0.0342","","","0.0865","0.0888","","","","","","1.029","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078633","20.0444","0.0009","12.6952","0.0006","20.6272","0.0009","90","","99.757","0.001","90","","5173","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5.95 H5.3 O0.19 P0.28 Pd0.09 S0.09 -","- C5.95349 H5.30233 O0.186047 P0.27907 Pd0.0930233 S0.0930233 -","- C256 H228 O8 P12 Pd4 S4 -","43","10.75","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0659","0.0462","","","0.1039","0.1152","","","","","","1.071","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078634","11.2946","0.0005","11.4688","0.0005","17.2693","0.0008","86.456","0.002","88.538","0.002","77.085","0.002","2176.07","0.17","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C54.5 H43 Cl O P3 Pt S -","- C54.5 H43 Cl O P3 Pt S -","- C109 H86 Cl2 O2 P6 Pt2 S2 -","2","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0322","0.0248","","","0.0545","0.0566","","","","","","1.041","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078635","13.3148","0.0005","15.3494","0.0005","18.7144","0.0006","90","","105.973","0.002","90","","3677.1","0.2","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 Cl F6 N O P3 Pd S -","- C38 H28 Cl F6 N O P3 Pd S -","- C152 H112 Cl4 F24 N4 O4 P12 Pd4 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0518","0.0356","","","0.0853","0.0961","","","","","","1.041","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078636","13.3596","0.0006","15.3077","0.0007","18.7872","0.0009","90","","106.112","0.002","90","","3691.2","0.3","296","2","296","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C38 H31 Cl F6 N O P3 Pt S -","- C38 H31 Cl F6 N O P3 Pt S -","- C152 H124 Cl4 F24 N4 O4 P12 Pt4 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0297","0.0234","","","0.0578","0.0608","","","","","","1.023","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078637","14.2182","0.0011","17.058","0.0013","15.6882","0.0012","90","","104.462","0.002","90","","3684.4","0.5","100","2","100","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C39 H34 F6 N O P3 Pd S -","- C39 H34 F6 N O P3 Pd S -","- C156 H136 F24 N4 O4 P12 Pd4 S4 -","4","2","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0","0.0372","","","0.079","0.0831","","","","","","1.031","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078638","8.936","0.002","16.722","0.004","25.078","0.006","90","","95.722","0.007","90","","3728.7","1.5","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C39 H34 F6 N O P3 Pt S -","- C39 H31 F6 N O P3 Pt S -","- C156 H124 F24 N4 O4 P12 Pt4 S4 -","4","1","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0302","0.0276","","","0.0682","0.0694","","","","","","1.134","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078639","14.9538","0.0004","14.9538","0.0004","30.2975","0.0009","90","","90","","120","","5867.3","0.3","100","2","100","2","","","","","","","","7","P 32 2 1","P 32 2""","154","","","","- C84 H80 F12 O5 P6 Pd2 S2 -","- C84 H80 F12 O5 P6 Pd2 S2 -","- C252 H240 F36 O15 P18 Pd6 S6 -","3","0.5","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0359","0.0314","","","0.0743","0.0764","","","","","","1.095","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078640","17.8021","0.0009","22.4724","0.0012","11.0253","0.0005","90","","90","","90","","4410.7","0.4","100","2","100","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C42 H37 F12 N3 O P4 Pd S -","- C42 H37 F12 N3 O P4 Pd S -","- C168 H148 F48 N12 O4 P16 Pd4 S4 -","4","0.5","","Suess, Daniel L. M.; Peters, Jonas C.","Late-Metal Diphosphinosulfinyl S(O)P2Pincer-type Complexes","Organometallics","2012","31","15","5213","","10.1021/om3001229","","","0.71073","MoKα","","0.0458","0.029","","","0.0621","0.0689","","","","","","1.035","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078641","9.7676","0.0003","8.3207","0.0003","27.1396","0.001","90","","101.583","0.002","90","","2160.8","0.13","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 O7 P W -","- C20 H23 O7 P W -","- C80 H92 O28 P4 W4 -","4","1","","Streubel, Rainer; Schneider, Eva; Schnakenburg, Gregor","Novel Spirooxaphosphirane Complexes","Organometallics","2012","31","13","4707","","10.1021/om300152y","","","0.71073","MoKα","","0.0566","0.0321","","","0.057","0.0616","","","","","","0.937","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078642","10.8467","0.0006","14.813","0.0008","12.9188","0.0007","90","","96.47","0.002","90","","2062.47","0.19","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 O7 P W -","- C19 H21 O7 P W -","- C76 H84 O28 P4 W4 -","4","1","","Streubel, Rainer; Schneider, Eva; Schnakenburg, Gregor","Novel Spirooxaphosphirane Complexes","Organometallics","2012","31","13","4707","","10.1021/om300152y","","","0.71073","MoKα","","0.0537","0.0349","","","0.0666","0.0732","","","","","","1.023","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078643","18.276","0.001","10.68","0.002","16.189","0.001","90","","90","","90","","3159.9","0.6","170","","170","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C37 H38 O3 P2 Ru -","- C37 H38 O3 P2 Ru -","- C148 H152 O12 P8 Ru4 -","4","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.025","0.024","","0.043","","0.042","","","1.052","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078644","16.548","0.001","11.421","0.002","18.348","0.001","90","","95.738","0.001","90","","3450.3","0.7","170","","170","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H37 F6 O3 P3 Ru -","- C36 H37 F6 O3 P3 Ru -","- C144 H148 F24 O12 P12 Ru4 -","4","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.066","0.054","","","0.118","0.133","","","","1.118","1.118","1.122","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078645","17.869","0.002","10.541","0.001","16.184","0.002","90","","90","","90","","3048.4","0.6","170","","170","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C36 H36 O3 P2 Ru -","- C36 H36 O3 P2 Ru -","- C144 H144 O12 P8 Ru4 -","4","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.036","0.034","","0.067","","0.056","","","1.27","","","1.07","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078646","8.84","0.001","12.126","0.002","16.502","0.003","80.644","0.003","80.18","0.003","73.254","0.003","1657","0.4","170","","170","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H34 Cl2 O2 P2 Ru -","- C36 H34 Cl2 O2 P2 Ru -","- C72 H68 Cl4 O4 P4 Ru2 -","2","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.054","0.046","","","0.109","0.119","","","","1.021","1.021","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078647","46.357","0.003","11.9083","0.0008","24.695","0.002","90","","107.864","0.001","90","","12975.2","1.6","170","","170","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H73 F6 O2 P5 Ru2 -","- C72 H73 F6 O2 P5 Ru2 -","- C576 H584 F48 O16 P40 Ru16 -","8","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.085","0.052","","","0.107","0.158","","","","1.013","1.013","1.209","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078648","9.4256","0.0007","16.016","0.001","20.502","0.001","90","","101.76","0.001","90","","3030","0.3","170","","170","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 O2 P2 Ru -","- C36 H34 O2 P2 Ru -","- C144 H136 O8 P8 Ru4 -","4","1","","Bowie, John H.; Bruce, Michael I.; Buntine, Mark A.; Gentleman, Alexander S.; Graham, David C.; Low, Paul J.; Metha, Gregory F.; Mitchell, Cassandra; Parker, Christian R.; Skelton, Brian W.; White, Allan H.","Facile Decarboxylation of Propiolic Acid on a Ruthenium Center and Related Chemistry","Organometallics","2012","31","15","5262","","10.1021/om300157w","","","0.71073","MoKα","","0.04","0.04","","","0.071","0.071","","","","1.096","1.096","1.096","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078649","29.509","0.002","9.5058","0.0007","22.7777","0.0017","90","","113.998","0.001","90","","5837","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H68 Cl8 O2 Si Zr -","- C54 H68 Cl8 O2 Si Zr -","- C216 H272 Cl32 O8 Si4 Zr4 -","4","0.5","","Nifant’ev, Ilya E.; Ivchenko, Pavel V.; Bagrov, Vladimir V.; Churakov, Andrei V.; Mercandelli, Pierluigi","5-Methoxy-Substituted Zirconium Bis-indenylansa-Complexes: Synthesis, Structure, and Catalytic Activity in the Polymerization and Copolymerization of Alkenes","Organometallics","2012","31","14","4962","","10.1021/om300160v","","","0.71073","MoKα","","0.0853","0.0688","","","0.1881","0.2008","","","","","","1.084","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078650","9.1156","0.0009","10.8683","0.0007","13.3557","0.0013","77.712","0.006","81.12","0.004","88.288","0.006","1277.3","0.2","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H27 O6 P Si2 W -","- C20 H27 O6 P Si2 W -","- C40 H54 O12 P2 Si4 W2 -","2","1","","Streubel, Rainer; Klein, Melina; Schnakenburg, Gregor","Probing the Group Tolerance of a Li/Cl Phosphinidenoid Complex Using Alkenyl-Substituted Aldehydes","Organometallics","2012","31","13","4711","","10.1021/om300177c","","","0.71073","MoKα","","0.0509","0.0369","","","0.0797","0.0839","","","","","","0.986","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078651","13.6791","0.0005","29.6551","0.001","16.42","0.0005","90","","90.54","0.003","90","","6660.6","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H30 Br2 O2 Si2 Sn -","- C12 H30 Br2 O2 Si2 Sn -","- C144 H360 Br24 O24 Si24 Sn12 -","12","3","","Haj, Samer Baba; Schürmann, Markus; Iovkova-Berends, Ljuba; Herres-Pawlis, Sonja; Jurkschat, Klaus","[Me2(i-PrO)SiCH2]2SnBr2: Evidence for Intramolecular Si‒O Bond Activation","Organometallics","2012","31","13","4716","","10.1021/om300200u","","","0.71073","MoKα","","0.1221","0.0472","","","0.1179","0.1371","","","","","","0.683","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078652","27.1091","0.0004","6.80307","0.00008","31.1056","0.0004","90","","101.432","0.0013","90","","5622.85","0.13","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Cl2 O2 Si2 Ti -","- C28 H34 Cl2 O2 Si2 Ti -","- C224 H272 Cl16 O16 Si16 Ti8 -","8","1","","Deally, Anthony; Hackenberg, Frauke; Lally, Grainne; Müller-Bunz, Helge; Tacke, Matthias","Synthesis and Cytotoxicity Studies of Silyl-Substituted Titanocene Dichloride Derivatives","Organometallics","2012","31","16","5782","","10.1021/om300227h","","","1.54184","CuKα","","0.0331","0.027","","","0.069","0.0712","","","","","","1.05","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078653","13.2693","0.0003","18.6775","0.0004","20.5498","0.0004","90","","90","","90","","5093.01","0.19","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H30 Cl2 Si2 Ti -","- C26 H30 Cl2 Si2 Ti -","- C208 H240 Cl16 Si16 Ti8 -","8","1","","Deally, Anthony; Hackenberg, Frauke; Lally, Grainne; Müller-Bunz, Helge; Tacke, Matthias","Synthesis and Cytotoxicity Studies of Silyl-Substituted Titanocene Dichloride Derivatives","Organometallics","2012","31","16","5782","","10.1021/om300227h","","","0.71073","MoKα","","0.0415","0.0293","","","0.0637","0.0699","","","","","","1.035","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078654","4.66648","0.00007","18.494","0.0002","20.8415","0.0003","90","","90","","90","","1798.66","0.04","233","2","233","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H10 F9 N O -","- C20 H10 F9 N O -","- C80 H40 F36 N4 O4 -","4","1","","Liu, Cham-Chuen; So, Loi-Chi; Lo, Jerry C. Y.; Chan, Michael C. W.; Kaneyoshi, Hiromu; Makio, Haruyuki","Highly Fluorinated (σ-Aryl)-Chelating Titanium(IV) Post-Metallocene: Characterization and Scalar [C–H···F–C] Coupling","Organometallics","2012","31","15","5274","","10.1021/om3002334","","","1.5418","CuKα","","0.0318","0.0304","","","0.0794","0.0804","","","","","","1.033","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078655","19.4593","0.0003","18.6396","0.0002","25.1695","0.0004","90","","90","","90","","9129.3","0.2","200","","200","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","[Tp'(CO)~2~MoCBF~2~(OMe)]K.C~12~H~24~O~6~.C~6~H~6~","","- C37 H55 B2 F2 K Mo N6 O9 -","- C37 H55 B2 F2 K Mo N6 O9 -","- C296 H440 B16 F16 K8 Mo8 N48 O72 -","8","1","","Hill, Anthony F.; Shang, Rong","Boratocarbyne Complexes: Li[Mo{≡CB(OMe)3}(CO)2{HB(pzMe2)3}] and [K(18-crown-6)][Mo(≡CBF2OMe)(CO)2{HB(pzMe2)3}] (pz = pyrazol-1-yl)","Organometallics","2012","31","13","4635","","10.1021/om300238m","","","0.71073","MoKα","","0.0555","0.0261","","0.1065","0.0737","0.1065","","","","","","0.9828","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078656","20.932","0.004","7.503","0.0017","20.915","0.004","90","","90","","90","","3284.8","1.2","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C17 H13 Cl3 N2 Ru -","- C17 H13 Cl3 N2 Ru -","- C136 H104 Cl24 N16 Ru8 -","8","2","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0846","0.0419","","","0.0904","0.1198","","","","","","1.075","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078657","18.964","0.003","15.138","0.002","19.467","0.003","90","","100.946","0.004","90","","5486.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Cl4 N2 Ru2 -","- C22 H20 Cl4 N2 Ru2 -","- C176 H160 Cl32 N16 Ru16 -","8","2","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0453","0.0306","","","0.0641","0.0684","","","","","","0.987","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078658","9.4222","0.0011","10.7102","0.0012","11.1569","0.0014","64.183","0.002","85.266","0.002","72.337","0.002","964.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H19 Cl N2 Ru S2 -","- C19 H19 Cl N2 Ru S2 -","- C38 H38 Cl2 N4 Ru2 S4 -","2","1","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0303","0.0262","","","0.0726","0.076","","","","","","0.783","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078659","36.395","0.006","8.7701","0.0013","18.326","0.003","90","","108.519","0.003","90","","5546.5","1.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H52 Cl3 N4 O7 Ru4 S4 -","- C48 H52 Cl3 N4 O7 Ru4 S4 -","- C192 H208 Cl12 N16 O28 Ru16 S16 -","4","0.5","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0398","0.0353","","","0.1027","0.1055","","","","","","1.104","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078660","10.178","0.0017","12.442","0.002","13.129","0.002","83.865","0.004","77.925","0.004","69.202","0.004","1518.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H18 Cl7 N3 O4 Ru2 -","- C25 H18 Cl7 N3 O4 Ru2 -","- C50 H36 Cl14 N6 O8 Ru4 -","2","1","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0847","0.054","","","0.145","0.1692","","","","","","1.066","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078661","9.0893","0.0008","9.4136","0.0008","10.684","0.0009","64.083","0.001","76.07","0.002","74.921","0.002","785.37","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H28 Cl4 N2 O4 Ru2 S2 -","- C26 H28 Cl4 N2 O4 Ru2 S2 -","- C26 H28 Cl4 N2 O4 Ru2 S2 -","1","0.5","","Mandal, Sutanuva; Samanta, Subhas; Mondal, Tapan K.; Goswami, Sreebrata","Comparative Study onortho-C‒H vsortho-C‒X (X = C, Cl, S) Bond Activation inortho-Caromatic‒N Bond Fusion in Substituted Anilines Using Ruthenium(II) Mediators: Isolation and Characterization of Unusual Ru2Complexes","Organometallics","2012","31","15","5282","","10.1021/om300241y","","","0.71073","MoKα","","0.0384","0.0376","","","0.115","0.1157","","","","","","1.12","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078662","7.0401","0.0008","13.2467","0.0016","12.9711","0.0015","90","","91.223","0.002","90","","1209.4","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 Mo S2 -","- C12 H16 Mo S2 -","- C48 H64 Mo4 S8 -","4","1","","Kuo, Louis Y.; Bentley, Anne K.; Shari’ati, Yusef A.; Smith, Curtis P.","Phosphonothioate Hydrolysis Turnover by Cp2MoCl2and Silver Nanoparticles","Organometallics","2012","31","15","5294","","10.1021/om300251w","","","0.71073","MoKα","","0.0251","0.0205","","","0.0446","0.0475","","","","","","1.032","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078663","6.8344","0.001","29.411","0.004","7.8777","0.0011","90","","110.176","0.002","90","","1486.3","0.4","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H21 F N2 O3 S Si -","- C10 H21 F N2 O3 S Si -","- C40 H84 F4 N8 O12 S4 Si4 -","4","1","","Nikolin, Alexei A.; Kramarova, Evgeniya P.; Shipov, Aleksander G.; Baukov, Yuri I.; Negrebetsky, Vadim V.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Bowden, Allen; Bylikin, Sergey Yu.; Bassindale, Alan R.; Taylor, Peter G.","Synthesis, Structures, and Stereodynamic Behavior of Novel Pentacoordinate Fluorosilanes: Fluorosilyl Derivatives of Proline","Organometallics","2012","31","14","4988","","10.1021/om3002697","","","0.71073","MoKα","","0.0606","0.0475","","","0.095","0.0989","","","","","","1.003","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078664","6.2309","0.0011","15.816","0.003","19.111","0.003","90","","90","","90","","1883.3","0.6","120","2","120","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C16 H25 F N2 O3 S Si -","- C16 H25 F N2 O3 S Si -","- C64 H100 F4 N8 O12 S4 Si4 -","4","1","","Nikolin, Alexei A.; Kramarova, Evgeniya P.; Shipov, Aleksander G.; Baukov, Yuri I.; Negrebetsky, Vadim V.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Bowden, Allen; Bylikin, Sergey Yu.; Bassindale, Alan R.; Taylor, Peter G.","Synthesis, Structures, and Stereodynamic Behavior of Novel Pentacoordinate Fluorosilanes: Fluorosilyl Derivatives of Proline","Organometallics","2012","31","14","4988","","10.1021/om3002697","","","0.71073","MoKα","","0.0923","0.0543","","","0.1087","0.1164","","","","","","0.953","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078665","6.2703","0.0004","16.3805","0.001","17.9546","0.0011","90","","90","","90","","1844.1","0.2","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 Cl F N2 O3 S Si -","- C15 H22 Cl F N2 O3 S Si -","- C60 H88 Cl4 F4 N8 O12 S4 Si4 -","4","1","","Nikolin, Alexei A.; Kramarova, Evgeniya P.; Shipov, Aleksander G.; Baukov, Yuri I.; Negrebetsky, Vadim V.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Bowden, Allen; Bylikin, Sergey Yu.; Bassindale, Alan R.; Taylor, Peter G.","Synthesis, Structures, and Stereodynamic Behavior of Novel Pentacoordinate Fluorosilanes: Fluorosilyl Derivatives of Proline","Organometallics","2012","31","14","4988","","10.1021/om3002697","","","0.71073","MoKα","","0.031","0.0278","","","0.0606","0.0618","","","","","","1.01","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078666","6.299","0.002","16.398","0.006","18.228","0.007","90","","90","","90","","1882.8","1.2","120","2","120","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 Br F N2 O3 S Si -","- C15 H22 Br F N2 O3 S Si -","- C60 H88 Br4 F4 N8 O12 S4 Si4 -","4","1","","Nikolin, Alexei A.; Kramarova, Evgeniya P.; Shipov, Aleksander G.; Baukov, Yuri I.; Negrebetsky, Vadim V.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Bowden, Allen; Bylikin, Sergey Yu.; Bassindale, Alan R.; Taylor, Peter G.","Synthesis, Structures, and Stereodynamic Behavior of Novel Pentacoordinate Fluorosilanes: Fluorosilyl Derivatives of Proline","Organometallics","2012","31","14","4988","","10.1021/om3002697","","","0.71073","MoKα","","0.1757","0.0737","","","0.1592","0.1894","","","","","","0.813","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078667","18.553","0.0016","7.4458","0.0006","26.979","0.002","90","","90","","90","","3726.9","0.5","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C15 H22 F N3 O5 S Si -","- C15 H22 F N3 O5 S Si -","- C120 H176 F8 N24 O40 S8 Si8 -","8","2","","Nikolin, Alexei A.; Kramarova, Evgeniya P.; Shipov, Aleksander G.; Baukov, Yuri I.; Negrebetsky, Vadim V.; Korlyukov, Alexander A.; Arkhipov, Dmitry E.; Bowden, Allen; Bylikin, Sergey Yu.; Bassindale, Alan R.; Taylor, Peter G.","Synthesis, Structures, and Stereodynamic Behavior of Novel Pentacoordinate Fluorosilanes: Fluorosilyl Derivatives of Proline","Organometallics","2012","31","14","4988","","10.1021/om3002697","","","0.71073","MoKα","","0.0934","0.0645","","","0.1254","0.1377","","","","","","1.079","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078668","20.6418","0.0009","10.9486","0.0005","20.9305","0.0009","90","","92.867","0.001","90","","4724.3","0.4","173","2","173","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C49 H54 Ir O4 P2 Rh Si3 -","- C49 H54 Ir O4 P2 Rh Si3 -","- C196 H216 Ir4 O16 P8 Rh4 Si12 -","4","0.5","","Mobarok, Md Hosnay; Ferguson, Michael J.; Cowie, Martin","Multiple Si‒H Bond Activations in a Bis(diethylphosphino)methane-Bridged Complex of Rhodium and Iridium: Synthesis of an Unusual Bis(silyl)/μ-Silylene Complex","Organometallics","2012","31","13","4722","","10.1021/om300283k","","","0.71073","MoKα","","0.0197","0.0171","","","0.0415","0.0434","","","","","","1.032","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078669","10.0265","0.0004","15.2613","0.0007","24.6102","0.0011","90","","93.734","0.001","90","","3757.8","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H56 Ir O2 P4 Rh Si -","- C32 H56 Ir O2 P4 Rh Si -","- C128 H224 Ir4 O8 P16 Rh4 Si4 -","4","1","","Mobarok, Md Hosnay; Ferguson, Michael J.; Cowie, Martin","Multiple Si‒H Bond Activations in a Bis(diethylphosphino)methane-Bridged Complex of Rhodium and Iridium: Synthesis of an Unusual Bis(silyl)/μ-Silylene Complex","Organometallics","2012","31","13","4722","","10.1021/om300283k","","","0.71073","MoKα","","0.0363","0.0262","","","0.057","0.0617","","","","","","1.026","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078670","11.5032","0.0004","17.1496","0.0006","18.5262","0.0006","90","","97.0573","0.0004","90","","3627.1","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H56 Ir O3 P4 Rh Si -","- C30 H56 Ir O3 P4 Rh Si -","- C120 H224 Ir4 O12 P16 Rh4 Si4 -","4","1","","Mobarok, Md Hosnay; Ferguson, Michael J.; Cowie, Martin","Multiple Si‒H Bond Activations in a Bis(diethylphosphino)methane-Bridged Complex of Rhodium and Iridium: Synthesis of an Unusual Bis(silyl)/μ-Silylene Complex","Organometallics","2012","31","13","4722","","10.1021/om300283k","","","0.71073","MoKα","","0.019","0.0178","","","0.0446","0.045","","","","","","1.107","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078671","10.3112","0.0003","36.574","0.0009","13.3312","0.0004","90","","107.432","0.003","90","","4796.6","0.2","173","","173","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 Al Cl2 I2 N2 O2 -","- C22 H17 Al Cl2 I2 N2 O2 -","- C176 H136 Al8 Cl16 I16 N16 O16 -","8","2","","Bakewell, Clare; Platel, Rachel H.; Cary, Samantha K.; Hubbard, Steven M.; Roaf, Joshua M.; Levine, Alex C.; White, Andrew J. P.; Long, Nicholas J.; Haaf, Michael; Williams, Charlotte K.","Bis(8-quinolinolato)aluminum ethyl complexes: Iso-Selective Initiators forrac-Lactide Polymerization","Organometallics","2012","31","13","4729","","10.1021/om300307t","","","0.71073","MoKα","","0.1196","0.0985","","","0.1947","0.2015","","","","","","1.184","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078672","16.321","0.0009","7.198","0.0004","5.013","0.0002","90","","90","","90","","588.92","0.05","153","2","153","2","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","dimethylsilanediyl bis(ethylcarbamate)","","- C8 H18 N2 O4 Si -","- C8 H18 N2 O4 Si -","- C16 H36 N4 O8 Si2 -","2","0.25","","Kraushaar, Konstantin; Wiltzsch, Conny; Wagler, Jörg; Böhme, Uwe; Schwarzer, Anke; Roewer, Gerhard; Kroke, Edwin","From CO2to Polysiloxanes: Di(carbamoyloxy)silanes Me2Si[(OCO)NRR′]2as Precursors for PDMS","Organometallics","2012","31","13","4779","","10.1021/om300313f","","","0.71073","MoKα","","0.0303","0.0277","","","0.0759","0.0784","","","","","","1.048","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078673","16.8885","0.0017","5.0436","0.0003","17.8135","0.0015","90","","112.459","0.004","90","","1402.2","0.2","90","2","90","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C10 H22 N2 O4 Si -","- C10 H22 N2 O4 Si -","- C40 H88 N8 O16 Si4 -","4","1","","Kraushaar, Konstantin; Wiltzsch, Conny; Wagler, Jörg; Böhme, Uwe; Schwarzer, Anke; Roewer, Gerhard; Kroke, Edwin","From CO2to Polysiloxanes: Di(carbamoyloxy)silanes Me2Si[(OCO)NRR′]2as Precursors for PDMS","Organometallics","2012","31","13","4779","","10.1021/om300313f","","","0.71073","MoKα","","0.1001","0.0481","","","0.0779","0.0845","","","","","","0.847","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078674","19.935","0.006","4.5756","0.0015","18.573","0.006","90","","94.004","0.007","90","","1690","0.9","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C7 H16 N2 O -","- C7 H16 N2 O -","- C56 H128 N16 O8 -","8","1","","Kraushaar, Konstantin; Wiltzsch, Conny; Wagler, Jörg; Böhme, Uwe; Schwarzer, Anke; Roewer, Gerhard; Kroke, Edwin","From CO2to Polysiloxanes: Di(carbamoyloxy)silanes Me2Si[(OCO)NRR′]2as Precursors for PDMS","Organometallics","2012","31","13","4779","","10.1021/om300313f","","","0.71073","MoKα","","0.0751","0.0545","","","0.1305","0.1382","","","","","","1.066","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078675","9.6323","0.0009","16.5241","0.0016","6.7869","0.0007","90","","109.008","0.002","90","","1021.34","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 Cl N2 Pt -","- C10 H11 Cl N2 Pt -","- C40 H44 Cl4 N8 Pt4 -","4","1","","Blackburn, Octavia A.; Coe, Benjamin J.; Helliwell, Madeleine; Raftery, James","Syntheses, Structures, and Electronic and Optical Properties of Platinum(II) Complexes of 1,3-Bis(imino)benzene-Derived Pincer Ligands","Organometallics","2012","31","15","5307","","10.1021/om3003152","","","0.71073","MoKα","","0.0248","0.0203","","","0.0414","0.0424","","","","","","1.034","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078676","10.0609","0.0013","10.0609","0.0013","31.897","0.006","90","","90","","90","","3228.7","0.8","100","2","100","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C18 H17 Cl N2 Pt -","- C18 H17 Cl N2 Pt -","- C144 H136 Cl8 N16 Pt8 -","8","1","","Blackburn, Octavia A.; Coe, Benjamin J.; Helliwell, Madeleine; Raftery, James","Syntheses, Structures, and Electronic and Optical Properties of Platinum(II) Complexes of 1,3-Bis(imino)benzene-Derived Pincer Ligands","Organometallics","2012","31","15","5307","","10.1021/om3003152","","","0.71073","MoKα","","0.041","0.0341","","","0.0646","0.0661","","","","","","1.165","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078677","8.415","0.003","9.746","0.003","19.733","0.007","81.192","0.004","80.322","0.004","71.961","0.004","1508.1","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H37 N2 P -","- C37 H37 N2 P -","- C74 H74 N4 P2 -","2","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Synthesis and Characterization of Nickel(II) and Palladium(II) Complexes based on Tridentate [N–NP] and [N–NS] Ligands and Their Applications in Norbornene Polymerization","Organometallics","2012","31","13","4748","","10.1021/om3003202","","","0.71073","MoKα","","0.0653","0.0541","","","0.1523","0.1632","","","","","","1.056","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078678","17.59","0.002","8.4278","0.0011","18.031","0.002","90","","92.592","0.002","90","","2670.3","0.5","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H32 N2 S -","- C31 H32 N2 S -","- C124 H128 N8 S4 -","4","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Synthesis and Characterization of Nickel(II) and Palladium(II) Complexes based on Tridentate [N–NP] and [N–NS] Ligands and Their Applications in Norbornene Polymerization","Organometallics","2012","31","13","4748","","10.1021/om3003202","","","0.71073","MoKα","","0.1152","0.0587","","","0.1543","0.1873","","","","","","0.95","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078679","9.361","0.003","17.219","0.006","17.64","0.006","90","","105.386","0.003","90","","2741.4","1.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H28 Cl N2 Ni P -","- C33 H28 Cl N2 Ni P -","- C132 H112 Cl4 N8 Ni4 P4 -","4","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Synthesis and Characterization of Nickel(II) and Palladium(II) Complexes based on Tridentate [N‒NP] and [N‒NS] Ligands and Their Applications in Norbornene Polymerization","Organometallics","2012","31","13","4748","","10.1021/om3003202","","","0.71073","MoKα","","0.059","0.0368","","","0.0781","0.0846","","","","","","0.911","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078680","9.342","0.003","22.935","0.008","30.025","0.01","90","","90","","90","","6433","4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C37 H36 Cl N2 Ni P -","- C37 H36 Cl N2 Ni P -","- C296 H288 Cl8 N16 Ni8 P8 -","8","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Synthesis and Characterization of Nickel(II) and Palladium(II) Complexes based on Tridentate [N‒NP] and [N‒NS] Ligands and Their Applications in Norbornene Polymerization","Organometallics","2012","31","13","4748","","10.1021/om3003202","","","0.71073","MoKα","","0.0629","0.0388","","","0.0872","0.0957","","","","","","0.947","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078681","9.1849","0.0009","17.4421","0.0016","17.5158","0.0016","90","","104.405","0.002","90","","2717.9","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H28 Cl N2 P Pd -","- C33 H28 Cl N2 P Pd -","- C132 H112 Cl4 N8 P4 Pd4 -","4","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Synthesis and Characterization of Nickel(II) and Palladium(II) Complexes based on Tridentate [N‒NP] and [N‒NS] Ligands and Their Applications in Norbornene Polymerization","Organometallics","2012","31","13","4748","","10.1021/om3003202","","","0.71073","MoKα","","0.0586","0.0346","","","0.1008","0.1262","","","","","","0.864","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078682","10.95","0.002","11.432","0.002","15.432","0.003","72.36","0.02","71.55","0.02","87.5","0.02","1743.4","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H38 O12 Zn3 -","- C35 H38 O12 Zn3 -","- C70 H76 O24 Zn6 -","2","1","","Petrus, Rafał; Sobota, Piotr","Zinc Complexes Supported by Maltolato Ligands: Synthesis, Structure, Solution Behavior, and Application in Ring-Opening Polymerization of Lactides","Organometallics","2012","31","13","4755","","10.1021/om300321h","","","0.71073","MoKα","","0.0536","0.0324","","","0.0729","0.0766","","","","","","0.914","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078683","8.529","0.003","8.529","0.003","18.948","0.005","90","","90","","120","","1193.7","0.7","100","2","100","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C17 H15 N O6 Zn -","- C17 H15 N O6 Zn -","- C51 H45 N3 O18 Zn3 -","3","0.5","","Petrus, Rafał; Sobota, Piotr","Zinc Complexes Supported by Maltolato Ligands: Synthesis, Structure, Solution Behavior, and Application in Ring-Opening Polymerization of Lactides","Organometallics","2012","31","13","4755","","10.1021/om300321h","","","0.71073","MoKα","","0.0361","0.0299","","","0.0648","0.0661","","","","","","1.008","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078684","8.536","0.002","10.173","0.002","12.628","0.003","97.45","0.02","102.25","0.02","105.67","0.02","1011.2","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H48 O14 Zn4 -","- C39 H48 O14 Zn4 -","- C39 H48 O14 Zn4 -","1","0.5","","Petrus, Rafał; Sobota, Piotr","Zinc Complexes Supported by Maltolato Ligands: Synthesis, Structure, Solution Behavior, and Application in Ring-Opening Polymerization of Lactides","Organometallics","2012","31","13","4755","","10.1021/om300321h","","","0.71073","MoKα","","0.0501","0.0326","","","0.0778","0.0817","","","","","","0.942","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078685","7.469","0.003","7.74","0.004","14.296","0.006","100.83","0.02","96.86","0.03","106.8","0.03","763.7","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H24 Cl4 O12 Zn2 -","- C26 H24 Cl4 O12 Zn2 -","- C26 H24 Cl4 O12 Zn2 -","1","0.5","","Petrus, Rafał; Sobota, Piotr","Zinc Complexes Supported by Maltolato Ligands: Synthesis, Structure, Solution Behavior, and Application in Ring-Opening Polymerization of Lactides","Organometallics","2012","31","13","4755","","10.1021/om300321h","","","0.71073","MoKα","","0.0876","0.0569","","","0.138","0.1468","","","","","","0.946","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078686","10.7987","0.0009","14.9644","0.0013","14.275","0.0012","90","","106.796","0.002","90","","2208.4","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonsk25","Pt(dippe)(OAc)2","","- C18 H38 O4 P2 Pt -","- C18 H38 O4 P2 Pt -","- C72 H152 O16 P8 Pt4 -","4","1","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon–Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.0633","0.036","","","0.0699","0.079","","","","","","1.019","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078687","17.8752","0.0011","11.7959","0.0007","17.3629","0.001","90","","107.584","0.001","90","","3490","0.4","100","0.5","100","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonkm07","Pt(dippe)(O2CPh)2","","- C35 H48 O6 P2 Pt -","- C35 H48 O6 P2 Pt -","- C140 H192 O24 P8 Pt4 -","4","1","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon–Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.0484","0.0286","","","0.0562","0.0622","","","","","","1.019","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078688","10.4961","0.0009","15.5935","0.0013","14.4889","0.0012","90","","105.047","0.001","90","","2290.1","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonsk47","Pt(dippe)(s-allyl)(OAc)","","- C19 H40 O2 P2 Pt -","- C19 H40 O2 P2 Pt -","- C76 H160 O8 P8 Pt4 -","4","1","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon‒Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.0771","0.0397","","","0.0711","0.0817","","","","","","1.026","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078689","9.1218","0.0007","15.4549","0.0011","15.8172","0.0012","90","","104.412","0.001","90","","2159.7","0.3","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","jonkm05","Pt(dippe)(eta2-vinylOAc)","","- C18 H38 O2 P2 Pt -","- C18 H38 O2 P2 Pt -","- C72 H152 O8 P8 Pt4 -","4","1","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon‒Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.027","0.0201","","","0.0429","0.0449","","","","","","1.03","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078690","10.5526","0.0006","10.5591","0.0006","15.7804","0.0009","82.093","0.001","70.687","0.001","71.712","0.001","1574.46","0.16","223","2","223","2","","","","","","","","5","P -1","-P 1","2","jonaw27","Pt(dippe)(k2-O2CC6H4)","","- C31 H51 O2 P2 Pt -","- C31 H51 O2 P2 Pt -","- C62 H102 O4 P4 Pt2 -","2","1","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon‒Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.0529","0.0342","","","0.0666","0.0721","","","","","","1.038","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078691","20.04","0.002","12.9198","0.0015","18.943","0.002","90","","114.115","0.002","90","","4476.5","0.8","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","jonaw25","Pt(dippe)(norbornyl)(O2CPh)","","- C21 H36 O2 P2 Pt -","- C21 H36 O2 P2 Pt -","- C168 H288 O16 P16 Pt8 -","8","2","","Manbeck, Kimberly A.; Kundu, Sabuj; Walsh, Aaron P.; Brennessel, William W.; Jones, William D.","Carbon‒Oxygen Bond Activation in Esters by Platinum(0): Cleavage of the Less Reactive Bond","Organometallics","2012","31","14","5018","","10.1021/om300323d","","","0.71073","MoKα","","0.0571","0.0303","","","0.0562","0.0635","","","","","","1.008","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078692","7.24","0.0018","9.098","0.003","14.711","0.005","88.652","0.011","80.572","0.01","67.346","0.007","881.3","0.5","200","","200","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H30 O2 Ru -","- C20 H30 O2 Ru -","- C40 H60 O4 Ru2 -","2","1","","Hirano, Masafumi; Okamoto, Takuya; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric Carbon‒Carbon Bond Forming Reaction of 1,3-Diene with 1,2-Diene in a Ruthenium(0) Complex","Organometallics","2012","31","13","4639","","10.1021/om300326q","","","0.71075","MoKα","","","0.0308","","","","0.0854","","","","","","0.686","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078693","7.3967","0.0015","11.632","0.003","19.008","0.004","90","","101.763","0.003","90","","1601.1","0.6","200","","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H30 Ru -","- C19 H30 Ru -","- C76 H120 Ru4 -","4","1","","Hirano, Masafumi; Okamoto, Takuya; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric Carbon‒Carbon Bond Forming Reaction of 1,3-Diene with 1,2-Diene in a Ruthenium(0) Complex","Organometallics","2012","31","13","4639","","10.1021/om300326q","","","0.71075","MoKα","","","0.0281","","","","0.086","","","","","","0.719","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078694","15.9511","0.0004","9.2259","0.0002","23.099","0.0006","90","","90","","90","","3399.32","0.14","173","2","173","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C31 H34 Cl2 N3 O2 P Pt S3 -","- C31 H34 Cl2 N3 O2 P Pt S3 -","- C124 H136 Cl8 N12 O8 P4 Pt4 S12 -","4","1","","Chellan, Prinessa; Land, Kirkwood M.; Shokar, Ajit; Au, Aaron; An, Seung Hwan; Clavel, Catherine M.; Dyson, Paul J.; Kock, Carmen de; Smith, Peter J.; Chibale, Kelly; Smith, Gregory S.","Exploring the Versatility of Cycloplatinated Thiosemicarbazones as Antitumor and Antiparasitic Agents","Organometallics","2012","31","16","5791","","10.1021/om300334z","","","0.71073","MoKα","","0.028","0.0214","","","0.0382","0.0403","","","","","","1.145","","","","has coordinates,has disorder","178675","2020-10-21","18:00:00",""
"4078695","14.7265","0.0006","30.6788","0.0014","14.2547","0.0006","90","","111.902","0.001","90","","5975.3","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 Cl8 N12 O3 Pt4 S7 -","- C42 H40 Cl8 N12 O3 Pt4 S7 -","- C168 H160 Cl32 N48 O12 Pt16 S28 -","4","0.5","","Chellan, Prinessa; Land, Kirkwood M.; Shokar, Ajit; Au, Aaron; An, Seung Hwan; Clavel, Catherine M.; Dyson, Paul J.; Kock, Carmen de; Smith, Peter J.; Chibale, Kelly; Smith, Gregory S.","Exploring the Versatility of Cycloplatinated Thiosemicarbazones as Antitumor and Antiparasitic Agents","Organometallics","2012","31","16","5791","","10.1021/om300334z","","","0.71073","MoKα","","0.0269","0.0204","","","0.0454","0.0485","","","","","","1.068","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078696","19.176","0.004","6.0493","0.0012","17.977","0.004","90","","114.13","0.03","90","","1903.1","0.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 Cl2 N6 P Pt S -","- C15 H19 Cl2 N6 P Pt S -","- C60 H76 Cl8 N24 P4 Pt4 S4 -","4","1","","Chellan, Prinessa; Land, Kirkwood M.; Shokar, Ajit; Au, Aaron; An, Seung Hwan; Clavel, Catherine M.; Dyson, Paul J.; Kock, Carmen de; Smith, Peter J.; Chibale, Kelly; Smith, Gregory S.","Exploring the Versatility of Cycloplatinated Thiosemicarbazones as Antitumor and Antiparasitic Agents","Organometallics","2012","31","16","5791","","10.1021/om300334z","","","0.71073","MoKα","","0.0216","0.0182","","","0.0389","0.0402","","","","","","1.126","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078697","21.6195","0.0004","13.4419","0.0003","15.0634","0.0003","90","","105.341","0.001","90","","4221.55","0.15","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 Au Cl N6 -","- C21 H22 Au Cl N6 -","- C168 H176 Au8 Cl8 N48 -","8","2","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0263","0.0208","","","0.0415","0.0428","","","","","","1.049","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078698","6.7513","0.0004","8.4871","0.0004","19.0475","0.001","98.467","0.004","90.93","0.004","94.482","0.004","1075.78","0.1","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H22 Au Br N6 -","- C21 H22 Au Br N6 -","- C42 H44 Au2 Br2 N12 -","2","1","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0296","0.0277","","","0.0697","0.0707","","","","","","1.01","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078699","21.3507","0.0003","16.799","0.0004","24.2172","0.0004","90","","90","","90","","8686","0.3","133","2","133","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C42 H44 Au F6 N12 P -","- C42 H44 Au F6 N12 P -","- C336 H352 Au8 F48 N96 P8 -","8","1","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0459","0.031","","","0.0462","0.0491","","","","","","1.094","","","","has coordinates","178675","2020-10-21","18:00:00",""
"4078700","37.4936","0.0008","14.7162","0.0003","26.6462","0.0006","90","","129.031","0.001","90","","11420.9","0.5","133","2","133","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C45 H50 Ag Au B F10 N12 O P -","- C45 H50 Ag Au B F10 N12 O P -","- C360 H400 Ag8 Au8 B8 F80 N96 O8 P8 -","8","1","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0514","0.0403","","","0.0987","0.1037","","","","","","1.041","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078701","12.597","0.0002","26.1408","0.0005","22.4153","0.0004","90","","98.377","0.001","90","","7302.5","0.2","133","2","133","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C56 H65 Ag3 Au B4 F16 N19 -","- C56 H65 Ag3 Au B4 F16 N19 -","- C224 H260 Ag12 Au4 B16 F64 N76 -","4","0.5","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0363","0.0336","","","0.0897","0.0911","","","","","","1.037","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078702","14.0308","0.0003","18.6868","0.0003","22.1264","0.0005","90","","106.613","0.002","90","","5559.2","0.2","133","2","133","2","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C44.75 H48 Au Cl4 Cu F9.75 N12 O2.25 P1.25 S0.75 -","- C44.75 H48 Au Cl4 Cu F9.75 N12 O2.25 P1.25 S0.75 -","- C179 H192 Au4 Cl16 Cu4 F39 N48 O9 P5 S3 -","4","1","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0542","0.0447","","","0.0991","0.1038","","","","","","1.044","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078703","7.9246","0.0003","8.6052","0.0004","36.7337","0.0015","83.326","0.003","84.118","0.003","69.502","0.003","2325.32","0.18","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H22 Au Cl3 N6 -","- C21 H22 Au Cl3 N6 -","- C84 H88 Au4 Cl12 N24 -","4","2","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0358","0.0323","","","0.0833","0.0851","","","","","","1.044","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078704","9.5169","0.0007","11.3837","0.0008","11.9104","0.0008","76.634","0.006","84.024","0.006","67.107","0.005","1156.36","0.15","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H21 Au Br2 N6 -","- C21 H21 Au Br2 N6 -","- C42 H42 Au2 Br4 N12 -","2","1","","Wimberg, Jan; Meyer, Steffen; Dechert, Sebastian; Meyer, Franc","Gold(I), Gold(III), and Heterometallic Gold(I)‒Silver(I) and Gold(I)‒Copper(I) Complexes of a Pyridazine-Bridged NHC/Pyrazole Hybrid Ligand and Their Initial Application in Catalysis","Organometallics","2012","31","14","5025","","10.1021/om300335w","","","0.71073","MoKα","","0.0374","0.0325","","","0.075","0.0772","","","","","","1.044","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078705","20.4758","0.0012","30.847","0.0018","13.1932","0.0007","90","","96.847","0.001","90","","8273.6","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C93 H94 Cl2 P4 Ru2 S2 -","- C93 H94 Cl2 P4 Ru2 S2 -","- C372 H376 Cl8 P16 Ru8 S8 -","4","1","","Xia, Jian-Long; Man, Wing Y.; Zhu, Xinxun; Zhang, Chan; Jin, Guo-Jun; Schauer, Phil A.; Fox, Mark A.; Yin, Jun; Yu, Guang-Ao; Low, Paul J.; Liu, Sheng Hua","Synthesis and Characterization of Dithia[3.3]paracyclophane-Bridged Binuclear Ruthenium Vinyl and Alkynyl Complexes","Organometallics","2012","31","15","5321","","10.1021/om300338j","","","0.71073","MoKα","","0.0687","0.0609","","","0.1418","0.1459","","","","","","1.149","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078706","7.434","0.003","11.928","0.005","13.261","0.005","61.393","0.009","81.831","0.013","87.954","0.016","1021.2","0.7","153","","153","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H27 N3 Ni O2 S3 -","- C17 H27 N3 Ni O2 S3 -","- C34 H54 N6 Ni2 O4 S6 -","2","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.062","","","","0.1816","","","","","","1.036","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078707","8.163","0.015","17.29","0.04","12.29","0.03","90","","91.418","0.014","90","","1734","7","153","","153","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C13 H27 N3 Ni S2 -","- C13 H27 N3 Ni S2 -","- C52 H108 N12 Ni4 S8 -","4","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.077","","","","0.2237","","","","","","0.958","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078708","7.941","0.004","21.451","0.011","24.46","0.012","90","","90","","90","","4167","4","153","","153","","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C32 H52 Cl F3 N3 Ni O6 Rh S4 -","- C32 H52 Cl F3 N3 Ni O6 Rh S4 -","- C128 H208 Cl4 F12 N12 Ni4 O24 Rh4 S16 -","4","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.7107","MoKα","","","0.0701","","","","0.2016","","","","","","1.069","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078709","26.689","0.015","53.49","0.03","8.506","0.005","90","","90","","90","","12143","12","393","","393","","","","","","","","","9","F d d 2","F 2 -2d","43","","","","- C23 H42 Cl F6 N3 Ni P Rh S2 -","- C23 H42 Cl F6 N3 Ni P Rh S2 -","- C368 H672 Cl16 F96 N48 Ni16 P16 Rh16 S32 -","16","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.0558","","","","0.1476","","","","","","1.096","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078710","15.9358","0.0008","15.9913","0.001","26.273","0.0018","90","","90","","90","","6695.3","0.7","153","","153","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C27 H42 N5 Ni O8 Rh S3 -","- C27 H42 N5 Ni O8 Rh S3 -","- C216 H336 N40 Ni8 O64 Rh8 S24 -","8","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.064","","","","0.1807","","","","","","1.182","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078711","10.1751","0.0015","18.314","0.002","18.8668","0.0019","102.06","0.003","97.969","0.005","99.346","0.007","3337.8","0.7","153","","153","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H46 N4 Ni O6.5 Rh S3 -","- C27 H43 N4 Ni O6.5 Rh S3 -","- C108 H172 N16 Ni4 O26 Rh4 S12 -","4","2","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.0497","","","","0.1585","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078712","8.406","0.003","13.931","0.005","14.394","0.005","111.789","0.002","95.614","0.0018","101.892","0.005","1503.1","0.9","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H46 N4 Ni O4.5 Rh S2 -","- C23 H43 N4 Ni O4.5 Rh S2 -","- C46 H86 N8 Ni2 O9 Rh2 S4 -","2","1","","Kure, Bunsho; Taniguchi, Ayami; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged NiRh Complexes with Tunable N3S2Dithiolato Ligands and Their Utilization as Catalysts for Hydrogenation of Aldehydes and CO2in Aqueous Media","Organometallics","2012","31","13","4791","","10.1021/om300350u","","","0.71075","MoKα","","","0.0475","","","","0.1395","","","","","","0.986","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078713","5.8929","0.0002","18.3495","0.0005","12.4034","0.0003","90","","95.514","0.001","90","","1335","0.07","103","0.1","103","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 Fe I O2 -","- C14 H15 Fe I O2 -","- C56 H60 Fe4 I4 O8 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Cawthray, Jacqueline F.; de Kock, Carmen; Patrick, Brian O.; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine Conjugates as Potential Antimalarials","Organometallics","2012","31","16","5736","","10.1021/om300354x","","","0.71073","MoKα","","0.0282","0.0228","","","0.0525","0.0542","","","","","","1.065","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078714","5.948","0.0002","9.7074","0.0003","24.3424","0.0008","90","","94.119","0.002","90","","1401.89","0.08","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Fe O4 -","- C16 H18 Fe O4 -","- C64 H72 Fe4 O16 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Cawthray, Jacqueline F.; de Kock, Carmen; Patrick, Brian O.; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine Conjugates as Potential Antimalarials","Organometallics","2012","31","16","5736","","10.1021/om300354x","","","0.71073","MoKα","","0.0336","0.0274","","","0.0657","0.0685","","","","","","1.023","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078715","5.7821","0.0002","16.7659","0.0007","25.3783","0.001","90","","90","","90","","2460.23","0.16","100","0.1","100","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 Fe O8 -","- C26 H34 Fe O8 -","- C104 H136 Fe4 O32 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Cawthray, Jacqueline F.; de Kock, Carmen; Patrick, Brian O.; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine Conjugates as Potential Antimalarials","Organometallics","2012","31","16","5736","","10.1021/om300354x","","","0.71073","MoKα","","0.0413","0.0317","","","0.0634","0.0669","","","","","","1.001","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078716","8.8628","0.0004","17.134","0.009","17.435","0.009","90","","101.76","0.02","90","","2592","1.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H27 Mo N3 O9 -","- C21 H27 Mo N3 O9 -","- C84 H108 Mo4 N12 O36 -","4","1","","Marques, Ana R.; Kromer, Lukas; Gallo, David J.; Penacho, Nuno; Rodrigues, Sandra S.; Seixas, João D.; Bernardes, Gonçalo J. L.; Reis, Patrícia M.; Otterbein, Sherrie L.; Ruggieri, Rachel A.; Gonçalves, Ana S. G.; Gonçalves, Ana M. L.; Matos, Marta N. De; Bento, Isabel; Otterbein, Leo E.; Blättler, Walter A.; Romão, Carlos C.","Generation of Carbon Monoxide Releasing Molecules (CO-RMs) as Drug Candidates for the Treatment of Acute Liver Injury: Targeting of CO-RMs to the Liver","Organometallics","2012","31","16","5810","","10.1021/om300360c","","","0.71073","MoKα","","0.0232","0.0195","","","0.0554","0.0581","","","","","","0.941","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078717","15.179","0.014","15.179","","47.282","0.005","90","","90","","120","","9434","9","150","2","150","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C36 H42 Mo2 N6 O28 -","- C36 H42 Mo2 N6 O27.98 -","- C216 H252 Mo12 N36 O167.88 -","6","0.166667","","Marques, Ana R.; Kromer, Lukas; Gallo, David J.; Penacho, Nuno; Rodrigues, Sandra S.; Seixas, João D.; Bernardes, Gonçalo J. L.; Reis, Patrícia M.; Otterbein, Sherrie L.; Ruggieri, Rachel A.; Gonçalves, Ana S. G.; Gonçalves, Ana M. L.; Matos, Marta N. De; Bento, Isabel; Otterbein, Leo E.; Blättler, Walter A.; Romão, Carlos C.","Generation of Carbon Monoxide Releasing Molecules (CO-RMs) as Drug Candidates for the Treatment of Acute Liver Injury: Targeting of CO-RMs to the Liver","Organometallics","2012","31","16","5810","","10.1021/om300360c","","","0.71073","MoKα","","0.0883","0.0688","","","0.2212","0.2434","","","","","","1.079","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078718","6.339","0.0002","11.9879","0.0003","15.194","0.0004","90","","99.009","0.001","90","","1140.37","0.05","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C6 H6 Br Fe N O3 S2 -","- C6 H6 Br Fe N O3 S2 -","- C24 H24 Br4 Fe4 N4 O12 S8 -","4","1","","Hewison, Lindsay; Crook, Sian H.; Mann, Brian E.; Meijer, Anthony J. H. M.; Adams, Harry; Sawle, Philip; Motterlini, Roberto A.","New Types of CO-Releasing Molecules (CO-RMs), Based on Iron Dithiocarbamate Complexes and [Fe(CO)3I(S2COEt)]","Organometallics","2012","31","16","5823","","10.1021/om3003637","","","0.71073","MoKα","","0.0311","0.0225","","","0.0533","0.0565","","","","","","1.042","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078719","6.2394","0.0006","25.384","0.003","9.7914","0.001","90","","95.476","0.002","90","","1543.7","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H10 Fe I2 N O3 S2 -","- C8 H10 Fe I2 N O3 S2 -","- C32 H40 Fe4 I8 N4 O12 S8 -","4","1","","Hewison, Lindsay; Crook, Sian H.; Mann, Brian E.; Meijer, Anthony J. H. M.; Adams, Harry; Sawle, Philip; Motterlini, Roberto A.","New Types of CO-Releasing Molecules (CO-RMs), Based on Iron Dithiocarbamate Complexes and [Fe(CO)3I(S2COEt)]","Organometallics","2012","31","16","5823","","10.1021/om3003637","","","0.71073","MoKα","","0.0285","0.0246","","","0.0594","0.0611","","","","","","1.001","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078720","16.233","0.002","21.0315","0.0009","20.908","0.003","90","","111.963","0.017","90","","6620","1.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H60 Cl3 N5 P2 Ru2 -","- C77 H60 Cl3 N5 P2 Ru2 -","- C308 H240 Cl12 N20 P8 Ru8 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; Zaitseva, Natasha N.","A Ruthenated [3]Dendralene from Phenylethyne and an η3-Butadienyl‒Ruthenium Complex","Organometallics","2012","31","14","5034","","10.1021/om300366g","","","0.71073","MoKα","","0.1328","0.0568","","","0.1127","0.1289","","","","","","0.902","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078721","14.029","0.002","20.6924","0.0017","24.0829","0.0019","90","","90","","90","","6991.1","1.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C87 H69 N5 P2 Ru2 -","- C87 H69 N5 P2 Ru2 -","- C348 H276 N20 P8 Ru8 -","4","1","","Bruce, Michael I.; Skelton, Brian W.; Zaitseva, Natasha N.","A Ruthenated [3]Dendralene from Phenylethyne and an η3-Butadienyl‒Ruthenium Complex","Organometallics","2012","31","14","5034","","10.1021/om300366g","","","0.71073","MoKα","","0.0756","0.0439","","","0.0535","0.0574","","","","","","0.789","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078722","11.884","0.006","17.73","0.009","23","0.011","90","","91.846","0.006","90","","4844","4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H51 O4.5 P2 Pd2 -","- C54 H50 O4.5 P2 Pd2 -","- C216 H200 O18 P8 Pd8 -","4","1","","Wakioka, Masayuki; Nakamura, Yuki; Wang, Qifeng; Ozawa, Fumiyuki","Direct Arylation of 2-Methylthiophene with Isolated [PdAr(μ-O2CR)(PPh3)]nComplexes: Kinetics and Mechanism","Organometallics","2012","31","13","4810","","10.1021/om300367k","","x-ray","0.7107","MoKα","","0.1172","0.0926","","","0.222","0.2411","","","","","","1.172","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078723","20.13","0.007","20.13","0.007","14.315","0.005","90","","90","","90","","5801","3","173","2","173","2","","","","","","","","6","I -4","I -4","82","","","","- C114 H112 Cl4 O8 P4 Pd4 -","- C114 H112 Cl4 O8 P4 Pd4 -","- C228 H224 Cl8 O16 P8 Pd8 -","2","0.25","","Wakioka, Masayuki; Nakamura, Yuki; Wang, Qifeng; Ozawa, Fumiyuki","Direct Arylation of 2-Methylthiophene with Isolated [PdAr(μ-O2CR)(PPh3)]nComplexes: Kinetics and Mechanism","Organometallics","2012","31","13","4810","","10.1021/om300367k","","x-ray","0.7107","MoKα","","0.1031","0.0862","","","0.2027","0.2147","","","","","","1.12","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078724","13.6884","0.0013","18.0387","0.0018","23","0.002","90","","98.4273","0.0016","90","","5617.9","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C59 H60 Cl2 O4 P2 Pd2 -","- C59 H60 Cl2 O4 P2 Pd2 -","- C236 H240 Cl8 O16 P8 Pd8 -","4","0.5","","Wakioka, Masayuki; Nakamura, Yuki; Wang, Qifeng; Ozawa, Fumiyuki","Direct Arylation of 2-Methylthiophene with Isolated [PdAr(μ-O2CR)(PPh3)]nComplexes: Kinetics and Mechanism","Organometallics","2012","31","13","4810","","10.1021/om300367k","","x-ray","0.7107","MoKα","","0.038","0.0357","","","0.1058","0.1078","","","","","","1.056","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078725","17.1047","0.0013","19.2401","0.0014","29.473","0.002","90","","90","","90","","9699.5","1.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C49 H76 N3 O2 Si Y -","- C49 H76 N3 O2 Si Y -","- C392 H608 N24 O16 Si8 Y8 -","8","1","","Karpov, Alexander V.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Reactions of Bis(alkyl)yttrium Complexes Supported by Bulky N,N Ligands with 2,6-Diisopropylaniline and Phenylacetylene","Organometallics","2012","31","15","5349","","10.1021/om300377h","","","0.71073","MoKα","","0.1653","0.0615","","","0.1048","0.125","","","","","","0.867","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078726","41.4345","0.0011","15.4298","0.0004","26.6797","0.0007","90","","128.25","0.001","90","","13395.2","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C70 H89 N6 Y -","- C70 H89 N6 Y -","- C560 H712 N48 Y8 -","8","1","","Karpov, Alexander V.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Reactions of Bis(alkyl)yttrium Complexes Supported by Bulky N,N Ligands with 2,6-Diisopropylaniline and Phenylacetylene","Organometallics","2012","31","15","5349","","10.1021/om300377h","","","0.71073","MoKα","","0.1112","0.061","","","0.1478","0.1657","","","","","","0.978","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078727","14.0702","0.0014","14.8777","0.0016","16.2464","0.0017","111.528","0.002","94.874","0.002","105.769","0.002","2979.1","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C65 H94 N3 O2 Y -","- C65 H94 N3 O2 Y -","- C130 H188 N6 O4 Y2 -","2","1","","Karpov, Alexander V.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Reactions of Bis(alkyl)yttrium Complexes Supported by Bulky N,N Ligands with 2,6-Diisopropylaniline and Phenylacetylene","Organometallics","2012","31","15","5349","","10.1021/om300377h","","","0.71073","MoKα","","0.0902","0.0538","","","0.1103","0.1204","","","","","","1.022","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078728","12.5802","0.0004","27.1104","0.0009","24.6206","0.0008","90","","97.372","0.001","90","","8327.6","0.5","100","2","100","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C96 H112 N4 Y2 -","- C96 H112 N4 Y2 -","- C384 H448 N16 Y8 -","4","1","","Karpov, Alexander V.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Reactions of Bis(alkyl)yttrium Complexes Supported by Bulky N,N Ligands with 2,6-Diisopropylaniline and Phenylacetylene","Organometallics","2012","31","15","5349","","10.1021/om300377h","","","0.71073","MoKα","","0.174","0.0704","","","0.1253","0.1462","","","","","","0.996","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078729","11.779","0.0002","18.578","0.0003","16.5703","0.0003","90","","102.245","0.0007","90","","3543.58","0.11","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H63 N O Ru3 -","- C37 H49 N O0.5 Ru3 -","- C148 H196 N4 O2 Ru12 -","4","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.042","0.0397","","","0.1004","0.1021","","","","","","1.044","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078730","8.8245","0.0007","11.0624","0.0008","20.5986","0.0016","78.9596","0.0019","77.611","0.002","72.0478","0.0019","1851.3","0.2","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H57 N O2 Ru3 -","- C38 H57 N O2 Ru3 -","- C76 H114 N2 O4 Ru6 -","2","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.0555","0.0374","","","0.0778","0.086","","","","","","1.022","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078731","8.7652","0.0005","10.8209","0.0007","19.2871","0.001","77.339","0.0015","77.769","0.0014","74.723","0.0014","1698.54","0.17","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H55 N O2 Ru3 -","- C37 H33 N O2 Ru3 -","- C74 H66 N2 O4 Ru6 -","2","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.1255","0.0573","","","0.1262","0.1877","","","","","","1.118","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078732","8.742","0.002","11.06","0.003","19.935","0.005","78.759","0.01","80.239","0.009","73.723","0.009","1801.1","0.8","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H57 N O2 Ru3 -","- C38 H32 N O2 Ru3 -","- C76 H64 N2 O4 Ru6 -","2","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.1063","0.0741","","","0.1849","0.2032","","","","","","1.209","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078733","10.86","0.004","10.789","0.003","16.04","0.005","92.581","0.012","97.913","0.014","113.972","0.012","1690.3","1","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H53 N Ru3 -","- C36 H52 N Ru3 -","- C72 H104 N2 Ru6 -","2","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.057","0.0403","","","0.0914","0.1082","","","","","","1.055","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078734","22.7341","0.0011","18.8043","0.0008","20.4728","0.0008","90","","124.293","0.0013","90","","7230.7","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H52 B F4 N Ru3 -","- C35 H52 B F4 N Ru3 -","- C280 H416 B8 F32 N8 Ru24 -","8","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.0616","0.053","","","0.1355","0.1415","","","","","","1.039","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078735","11.5539","0.0017","13.726","0.003","17.284","0.004","70.873","0.01","86.569","0.01","81.514","0.01","2561.2","0.9","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H76 B N Ru3 -","- C60 H76 B N Ru3 -","- C120 H152 B2 N2 Ru6 -","2","1","","Takao, Toshiro; Kawashima, Takashi; Kanda, Hideyuki; Okamura, Rei; Suzuki, Hiroharu","Synthesis of Triruthenium Complexes Containing a Triply Bridging Pyridyl Ligand and Its Transformations to Face-Capping Pyridine and Perpendicularly Coordinated Pyridyl Ligands","Organometallics","2012","31","13","4817","","10.1021/om300379d","","","0.71069","MoKα","","0.0273","0.0244","","","0.0597","0.0612","","","","","","1.043","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078736","23.0836","0.0003","9.2876","0.0001","18.8179","0.0002","90","","95.94","0.001","90","","4012.73","0.08","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","[Pd(dppe)(H2O)2](OTs)2","","- C40 H42 O8 P2 Pd S2 -","- C40 H42 O8 P2 Pd S2 -","- C160 H168 O32 P8 Pd4 S8 -","4","1","","Oberhauser, Werner; Ienco, Andrea; Vizza, Francesco; Trettenbrein, Barbara; Oberhuber, Dennis; Strabler, Christof; Ortner, Teresa; Brüggeller, Peter","Regioselective Hydromethoxycarbonylation of Terminal Alkynes Catalyzed by Palladium(II)–Tetraphos Complexes","Organometallics","2012","31","13","4832","","10.1021/om3003812","","","0.71073","MoKα","","0.0239","0.0226","","","0.0534","0.0541","","","","","","1.048","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078737","11.4567","0.0004","12.3501","0.0004","12.3652","0.0005","73.181","0.003","84.086","0.003","76.133","0.003","1624.85","0.11","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","[Pd2(CH3)2Cl2(dppcb)]","","- C66 H78 Cl2 N4 O4 P4 Pd2 -","- C66 H78 Cl2 N4 O4 P4 Pd2 -","- C66 H78 Cl2 N4 O4 P4 Pd2 -","1","0.5","","Oberhauser, Werner; Ienco, Andrea; Vizza, Francesco; Trettenbrein, Barbara; Oberhuber, Dennis; Strabler, Christof; Ortner, Teresa; Brüggeller, Peter","Regioselective Hydromethoxycarbonylation of Terminal Alkynes Catalyzed by Palladium(II)‒Tetraphos Complexes","Organometallics","2012","31","13","4832","","10.1021/om3003812","","","1.5418","CuKα","","0.052","0.0466","","","0.1354","0.1448","","","","","","1.14","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078738","34.4649","0.0002","10.3378","0.0003","24.0599","0.0003","90","","131.823","0.0009","90","","6388.2","0.2","243","2","243","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Pd2(allyl)2(dppcb)](PF6)2","","- C59 H54 Cl2 F12 P6 Pd2 -","- C59 H54 Cl2 F12 P6 Pd2 -","- C236 H216 Cl8 F48 P24 Pd8 -","4","0.5","","Oberhauser, Werner; Ienco, Andrea; Vizza, Francesco; Trettenbrein, Barbara; Oberhuber, Dennis; Strabler, Christof; Ortner, Teresa; Brüggeller, Peter","Regioselective Hydromethoxycarbonylation of Terminal Alkynes Catalyzed by Palladium(II)‒Tetraphos Complexes","Organometallics","2012","31","13","4832","","10.1021/om3003812","","","0.71073","MoKα","","0.0448","0.0367","","","0.0903","0.0995","","","","","","1.014","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078739","11.5785","0.0002","18.7728","0.0003","19.227","0.0003","90","","105.147","0.002","90","","4034.01","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Pd(meso-dppb)(H2O)2](OTs)2","","- C42 H46 O8 P2 Pd S2 -","- C42 H46 O8 P2 Pd S2 -","- C168 H184 O32 P8 Pd4 S8 -","4","1","","Oberhauser, Werner; Ienco, Andrea; Vizza, Francesco; Trettenbrein, Barbara; Oberhuber, Dennis; Strabler, Christof; Ortner, Teresa; Brüggeller, Peter","Regioselective Hydromethoxycarbonylation of Terminal Alkynes Catalyzed by Palladium(II)–Tetraphos Complexes","Organometallics","2012","31","13","4832","","10.1021/om3003812","","","0.71073","MoKα","","0.0483","0.0335","","","0.0725","0.0791","","","","","","1.028","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078740","9.4063","0.0013","15.1759","0.0018","15.648","0.003","85.993","0.011","74.259","0.013","78.082","0.012","2103.4","0.6","200","","200","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H22 Fe O2.5 -","- C26 H22 Fe O2.5 -","- C104 H88 Fe4 O10 -","4","2","","Görmen, Meral; Pigeon, Pascal; Hillard, Elizabeth A.; Vessières, Anne; Huché, Michel; Richard, Marie-Aude; McGlinchey, Michael J.; Top, Siden; Jaouen, Gérard","Synthesis and Antiproliferative Effects of [3]Ferrocenophane Transposition Products and Pinacols Obtained from McMurry Cross-Coupling Reactions","Organometallics","2012","31","16","5856","","10.1021/om300382h","","","0.71073","MoKα","","0.1132","0.0654","","0.2083","0.1762","0.2083","","","","","","0.9575","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078741","12.9557","0.0014","9.4401","0.0008","17.11","0.002","90","","109.949","0.007","90","","1967","0.4","200","","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 Fe O -","- C26 H22 Fe O -","- C104 H88 Fe4 O4 -","4","1","","Görmen, Meral; Pigeon, Pascal; Hillard, Elizabeth A.; Vessières, Anne; Huché, Michel; Richard, Marie-Aude; McGlinchey, Michael J.; Top, Siden; Jaouen, Gérard","Synthesis and Antiproliferative Effects of [3]Ferrocenophane Transposition Products and Pinacols Obtained from McMurry Cross-Coupling Reactions","Organometallics","2012","31","16","5856","","10.1021/om300382h","","","0.71073","MoKα","","0.0849","0.0435","","0.1058","0.0893","0.1058","","","","","","0.8948","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078742","8.1136","0.0006","19.4485","0.0013","12.648","0.001","90","","104.028","0.007","90","","1936.3","0.3","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Fe2 O2 -","- C26 H26 Fe2 O2 -","- C104 H104 Fe8 O8 -","4","1","","Görmen, Meral; Pigeon, Pascal; Hillard, Elizabeth A.; Vessières, Anne; Huché, Michel; Richard, Marie-Aude; McGlinchey, Michael J.; Top, Siden; Jaouen, Gérard","Synthesis and Antiproliferative Effects of [3]Ferrocenophane Transposition Products and Pinacols Obtained from McMurry Cross-Coupling Reactions","Organometallics","2012","31","16","5856","","10.1021/om300382h","","","0.71073","MoKα","","0.0468","0.029","","0.0742","0.0669","0.0742","","","","","","0.9207","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078743","13.258","0.003","15.273","0.003","14.915","0.003","90","","106.07","0.03","90","","2902.1","1.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H29 Cl2 Fe N3 -","- C27 H29 Cl2 Fe N3 -","- C108 H116 Cl8 Fe4 N12 -","4","1","","Zhang, Wenjuan; Chai, Wenbin; Sun, Wen-Hua; Hu, Xinquan; Redshaw, Carl; Hao, Xiang","2-(1-(Arylimino)ethyl)-8-arylimino-5,6,7-trihydroquinoline Iron(II) Chloride Complexes: Synthesis, Characterization, and Ethylene Polymerization Behavior","Organometallics","2012","31","14","5039","","10.1021/om300388m","","","0.71073","MoKα","","","0.0735","","","0.204","0.2188","","","","","","1.06","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078744","18.586","0.004","8.6751","0.0017","18.151","0.004","90","","99.69","0.03","90","","2884.8","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H37 Cl2 Fe N3 -","- C31 H36.106 Cl2 Fe N3 -","- C124 H144.424 Cl8 Fe4 N12 -","4","1","","Zhang, Wenjuan; Chai, Wenbin; Sun, Wen-Hua; Hu, Xinquan; Redshaw, Carl; Hao, Xiang","2-(1-(Arylimino)ethyl)-8-arylimino-5,6,7-trihydroquinoline Iron(II) Chloride Complexes: Synthesis, Characterization, and Ethylene Polymerization Behavior","Organometallics","2012","31","14","5039","","10.1021/om300388m","","","0.71073","MoKα","","","0.0734","","","0.1756","0.1892","","","","","","1.077","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078745","28.118","0.001","33.105","0.001","18.385","0.001","90","","90","0.001","90","","17113.6","1.2","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H54 Li2 N2 O P2 -","- C48 H54 Li2 N2 O P2 -","- C768 H864 Li32 N32 O16 P32 -","16","4","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.088","0.0574","","","0.139","0.1563","","","","","","0.989","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078746","10.637","0.001","11.054","0.001","21.721","0.001","80.508","0.001","79.326","0.001","62.992","0.001","2226.5","0.3","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C50 H58 Li2 N2 O2 P2 -","- C50 H58 Li2 N2 O2 P2 -","- C100 H116 Li4 N4 O4 P4 -","2","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0718","0.0501","","","0.141","0.1526","","","","","","1.084","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078747","11.164","0.001","19.772","0.001","19.576","0.001","90","","101.293","0.001","90","","4237.4","0.5","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H56 Li2 N2 O P2 -","- C48 H56 Li2 N2 O P2 -","- C192 H224 Li8 N8 O4 P8 -","4","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0678","0.0461","","","0.1251","0.1361","","","","","","1.072","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078748","17.258","0.001","11.338","0.001","26.404","0.001","90","","115.468","0.003","90","","4664.5","0.5","150","0.1","150","0.1","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C39 H59 Cl4 Li2 N O4.5 P Si Y -","- C37 H55 Cl4 Li2 N O4 P Si Y -","- C148 H220 Cl16 Li8 N4 O16 P4 Si4 Y4 -","4","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0671","0.0498","","","0.1009","0.1095","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078749","19.475","0.001","9.673","0.001","25.108","0.001","90","","103.016","0.001","90","","4608.4","0.6","150","0.1","150","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H58 Cl N2 O2 P2 Y -","- C50 H58 Cl N2 O2 P2 Y -","- C200 H232 Cl4 N8 O8 P8 Y4 -","4","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0806","0.0423","","","0.089","0.0989","","","","","","1.013","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078750","13.147","0.001","15.142","0.001","18.314","0.001","88.807","0.001","70.318","0.001","85.995","0.001","3424.4","0.4","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C73 H77 N3 Nd P3 -","- C66 H69 N3 Nd P3 -","- C132 H138 N6 Nd2 P6 -","2","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0553","0.0487","","","0.1196","0.1244","","","","","","1.117","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078751","13.154","0.001","15.279","0.001","18.133","0.001","88.449","0.001","69.426","0.001","84.688","0.001","3397.2","0.4","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C77 H85 La N3 O P3 -","- C66 H69 La N3 P3 -","- C132 H138 La2 N6 P6 -","2","1","","Martinez-Arripe, Elsa; Jean-Baptiste-dit-Dominique, François; Auffrant, Audrey; Le Goff, Xavier-Frédéric; Thuilliez, Julien; Nief, François","Synthesis and Characterization of Bidentate Rare-Earth Iminophosphoraneo-Aryl Complexes and Their Behavior As Catalysts for the Polymerization of 1,3-Butadiene","Organometallics","2012","31","13","4854","","10.1021/om300389v","","","0.71069","MoKα","","0.0549","0.0474","","","0.1207","0.126","","","","","","1.076","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078752","9.5834","0.0009","15.1988","0.0014","16.8616","0.0015","90","","90","","90","","2456","0.4","90","0.1","90","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H23 F6 Fe N O4 -","- C27 H23 F6 Fe N O4 -","- C108 H92 F24 Fe4 N4 O16 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Patrick, Brian O.; Kock, Carmen de; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","Modular Synthesis of 1,2- and 1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine and Mefloquine Conjugates as Potential Antimalarial Agents","Organometallics","2012","31","16","5748","","10.1021/om300392q","","","0.71073","MoKα","","0.0329","0.027","","","0.0615","0.0638","","","","","","1.018","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078753","7.8812","0.0007","10.6659","0.001","23.064","0.002","90","","90","","90","","1938.8","0.3","90","0.1","90","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H13 F6 Fe N O2 -","- C22 H13 F6 Fe N O2 -","- C88 H52 F24 Fe4 N4 O8 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Patrick, Brian O.; Kock, Carmen de; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","Modular Synthesis of 1,2- and 1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine and Mefloquine Conjugates as Potential Antimalarial Agents","Organometallics","2012","31","16","5748","","10.1021/om300392q","","","0.71073","MoKα","","0.0356","0.0294","","","0.0697","0.0724","","","","","","1.025","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078754","22.5656","0.0019","22.671","0.002","7.5829","0.0007","90","","90","","90","","3879.3","0.6","90","0.1","90","0.1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C45 H39 Cl2 Fe2 N2 O4 -","- C45 H39 Cl2 Fe2 N2 O4 -","- C180 H156 Cl8 Fe8 N8 O16 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Patrick, Brian O.; Kock, Carmen de; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","Modular Synthesis of 1,2- and 1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine and Mefloquine Conjugates as Potential Antimalarial Agents","Organometallics","2012","31","16","5748","","10.1021/om300392q","","","0.71073","MoKα","","0.0437","0.0355","","","0.0821","0.0856","","","","","","1.05","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078755","10.5639","0.0002","15.183","0.0003","13.6404","0.0003","90","","97.504","0.001","90","","2169.07","0.08","100","0.2","100","0.2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H19 F6 Fe N O3 -","- C25 H19 F6 Fe N O3 -","- C100 H76 F24 Fe4 N4 O12 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Patrick, Brian O.; Kock, Carmen de; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","Modular Synthesis of 1,2- and 1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine and Mefloquine Conjugates as Potential Antimalarial Agents","Organometallics","2012","31","16","5748","","10.1021/om300392q","","","0.71073","MoKα","","0.0401","0.03","","","0.0648","0.0686","","","","","","1.035","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078756","7.6745","0.0004","10.6388","0.0004","23.4651","0.0009","90","","95.058","0.002","90","","1908.41","0.14","90","0.1","90","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H13 F6 Fe N O2 -","- C22 H13 F6 Fe N O2 -","- C88 H52 F24 Fe4 N4 O8 -","4","1","","Herrmann, Christoph; Salas, Paloma F.; Patrick, Brian O.; Kock, Carmen de; Smith, Peter J.; Adam, Michael J.; Orvig, Chris","Modular Synthesis of 1,2- and 1,1′-Disubstituted Ferrocenyl Carbohydrate Chloroquine and Mefloquine Conjugates as Potential Antimalarial Agents","Organometallics","2012","31","16","5748","","10.1021/om300392q","","","0.71073","MoKα","","0.0757","0.0532","","","0.1374","0.1503","","","","","","1.092","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078757","6.6256","0.0003","11.4304","0.0006","20.0706","0.001","95.927","0.001","94.45","0.001","95.064","0.001","1500.21","0.13","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H76 N4 Na4 O27 S8 Zn2 -","- C29 H73 N4 Na4 O27 S8 Zn2 -","- C29 H73 N4 Na4 O27 S8 Zn2 -","1","0.5","","Lecina, J.; Carrer, A.; Álvarez-Larena, A.; Mazzi, U.; Melendez-Alafort, L.; Suades, J.","New Bioconjugated Rhenium Carbonyls by Transmetalation Reaction with Zinc Derivatives","Organometallics","2012","31","16","5884","","10.1021/om300394v","","","0.71073","MoKα","","0.0382","0.0321","","","0.0847","0.0882","","","","","","1.042","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078758","14.919","0.003","11.373","0.003","18.544","0.004","90","","92.24","0.004","90","","3144","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H61 N11 O16 S8 Zn2 -","- C50 H61 N11 O16 S8 Zn2 -","- C100 H122 N22 O32 S16 Zn4 -","2","0.5","","Lecina, J.; Carrer, A.; Álvarez-Larena, A.; Mazzi, U.; Melendez-Alafort, L.; Suades, J.","New Bioconjugated Rhenium Carbonyls by Transmetalation Reaction with Zinc Derivatives","Organometallics","2012","31","16","5884","","10.1021/om300394v","","","0.71073","MoKα","","0.2548","0.1037","","","0.1618","0.2094","","","","","","0.97","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078759","21.3425","0.0015","10.2797","0.0007","31.001","0.002","90","","100.394","0.002","90","","6689.8","0.8","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 N2 O6 P Re S2 -","- C32 H32 N2 O6 P Re S2 -","- C256 H256 N16 O48 P8 Re8 S16 -","8","2","","Lecina, J.; Carrer, A.; Álvarez-Larena, A.; Mazzi, U.; Melendez-Alafort, L.; Suades, J.","New Bioconjugated Rhenium Carbonyls by Transmetalation Reaction with Zinc Derivatives","Organometallics","2012","31","16","5884","","10.1021/om300394v","","","0.71073","MoKα","","0.1906","0.073","","","0.0942","0.1219","","","","","","0.937","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078760","13.3812","0.0011","7.5998","0.0007","17.7777","0.0015","90","","111.504","0.001","90","","1682","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 N Rh -","- C21 H24 N Rh -","- C84 H96 N4 Rh4 -","4","1","","Hu, Yue; Li, Ling; Shaw, Anthony P.; Norton, Jack R.; Sattler, Wesley; Rong, Yi","Synthesis, Electrochemistry, and Reactivity of New Iridium(III) and Rhodium(III) Hydrides","Organometallics","2012","31","14","5058","","10.1021/om300398r","","","0.71073","MoKα","","0.0529","0.034","","","0.0716","0.0782","","","","","","1.042","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078761","13.3885","0.0011","7.5832","0.0006","17.8084","0.0014","90","","111.513","0.001","90","","1682.1","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 Ir N -","- C21 H24 Ir N -","- C84 H96 Ir4 N4 -","4","1","","Hu, Yue; Li, Ling; Shaw, Anthony P.; Norton, Jack R.; Sattler, Wesley; Rong, Yi","Synthesis, Electrochemistry, and Reactivity of New Iridium(III) and Rhodium(III) Hydrides","Organometallics","2012","31","14","5058","","10.1021/om300398r","","","0.71073","MoKα","","0.0493","0.0308","","","0.0555","0.0612","","","","","","1.021","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078762","23.252","0.002","13.3085","0.0012","15.6748","0.0014","90","","101.991","0.001","90","","4744.7","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 F6 N2 P Rh -","- C23 H26 F6 N2 P Rh -","- C184 H208 F48 N16 P8 Rh8 -","8","2","","Hu, Yue; Li, Ling; Shaw, Anthony P.; Norton, Jack R.; Sattler, Wesley; Rong, Yi","Synthesis, Electrochemistry, and Reactivity of New Iridium(III) and Rhodium(III) Hydrides","Organometallics","2012","31","14","5058","","10.1021/om300398r","","","0.71073","MoKα","","0.0557","0.0364","","","0.0781","0.0861","","","","","","1.023","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078763","23.294","0.002","13.2622","0.0012","15.6968","0.0015","90","","101.878","0.001","90","","4745.4","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 F6 Ir N2 P -","- C23 H26 F6 Ir N2 P -","- C184 H208 F48 Ir8 N16 P8 -","8","2","","Hu, Yue; Li, Ling; Shaw, Anthony P.; Norton, Jack R.; Sattler, Wesley; Rong, Yi","Synthesis, Electrochemistry, and Reactivity of New Iridium(III) and Rhodium(III) Hydrides","Organometallics","2012","31","14","5058","","10.1021/om300398r","","","0.71073","MoKα","","0.0564","0.0331","","","0.0643","0.0721","","","","","","1.009","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078764","19.215","0.004","9.0535","0.0018","23.233","0.005","90","","108.52","0.03","90","","3832.4","1.5","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H54 Br N5 Ni -","- C38 H54 Br N5 Ni -","- C152 H216 Br4 N20 Ni4 -","4","1","","Zell, Thomas; Fischer, Peter; Schmidt, David; Radius, Udo","C‒Br Activation of Aryl Bromides at Ni0(NHC)2: Stoichiometric Reactions, Catalytic Application in Suzuki‒Miyaura Cross-Coupling, and Catalyst Degradation","Organometallics","2012","31","14","5065","","10.1021/om300399j","","","0.71073","MoKα","","0.0647","0.0492","","","0.1104","0.1169","","","","","","1.091","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078765","21.236","0.004","20.872","0.004","16.673","0.003","90","","106.39","0.03","90","","7090","3","203","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 Br4 N4 Ni -","- C30 H42 Br4 N4 Ni -","- C240 H336 Br32 N32 Ni8 -","8","2","","Zell, Thomas; Fischer, Peter; Schmidt, David; Radius, Udo","C‒Br Activation of Aryl Bromides at Ni0(NHC)2: Stoichiometric Reactions, Catalytic Application in Suzuki‒Miyaura Cross-Coupling, and Catalyst Degradation","Organometallics","2012","31","14","5065","","10.1021/om300399j","","","0.71073","MoKα","","0.102","0.0816","","","0.2208","0.237","","","","","","1.068","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078766","8.0443","0.0001","10.6437","0.0002","14.8659","0.001","97.741","0.007","91.333","0.006","97.375","0.007","1249.74","0.09","85","2","85","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H39 N2 O3.5 P Ru -","- C23 H39 N2 O3.5 P Ru -","- C46 H78 N4 O7 P2 Ru2 -","2","1","","Huff, Chelsea A.; Kampf, Jeff W.; Sanford, Melanie S.","Role of a Noninnocent Pincer Ligand in the Activation of CO2at (PNN)Ru(H)(CO)","Organometallics","2012","31","13","4643","","10.1021/om300403b","","","1.54178","CuKα","","0.0302","0.0295","","","0.0809","0.0816","","","","","","1.086","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078767","11.0288","0.0005","16.9223","0.0007","18.77","0.0007","90","","105.523","0.002","90","","3375.3","0.2","103","2","103","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C39 H41 Cl N O1.5 P Pd -","- C39 H41 Cl N O1.5 P Pd -","- C156 H164 Cl4 N4 O6 P4 Pd4 -","4","2","","Huang, Yinhua; Pullarkat, Sumod A.; Teong, Siewping; Chew, Renta Jonathan; Li, Yongxin; Leung, Pak-Hing","Palladacycle-Catalyzed Asymmetric Intermolecular Construction of Chiral Tertiary P-Heterocycles by Stepwise Addition of H‒P‒H Bonds to Bis(enones)","Organometallics","2012","31","13","4871","","10.1021/om300405h","","","0.71073","MoKα","","0.1183","0.0623","","","0.1389","0.1763","","","","","","1.011","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078768","15.523","0.003","19.47","0.004","22.098","0.005","90","","90","","90","","6679","2","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C30 H51 B2 Cl O4 Os P2 -","- C30 H51 B2 Cl O4 Os P2 -","- C240 H408 B16 Cl8 O32 Os8 P16 -","8","2","","Esteruelas, Miguel A.; Fernández, Israel; López, Ana M.; Mora, Malka; Oñate, Enrique","Preparation, Structure, Bonding, and Preliminary Reactivity of a Six-Coordinate d4Osmium‒Boryl Complex","Organometallics","2012","31","13","4646","","10.1021/om300407d","","","0.71073","MoKα","","0.0527","0.0451","","","0.0735","0.0756","","","","","","1.146","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078769","11.2704","0.0006","15.3793","0.0009","17.3091","0.001","90","","90","","90","","3000.2","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C26 H46 B Cl O4 Os P2 -","- C26 H46 B Cl O4 Os P2 -","- C104 H184 B4 Cl4 O16 Os4 P8 -","4","1","","Esteruelas, Miguel A.; Fernández, Israel; López, Ana M.; Mora, Malka; Oñate, Enrique","Preparation, Structure, Bonding, and Preliminary Reactivity of a Six-Coordinate d4Osmium‒Boryl Complex","Organometallics","2012","31","13","4646","","10.1021/om300407d","","","0.71073","MoKα","","0.039","0.0288","","","0.0517","0.0541","","","","","","1.056","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078770","16.246","0.003","10.8358","0.0018","16.886","0.003","90","","106.226","0.002","90","","2854.2","0.9","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H46 B Cl O3 Os P2 -","- C25 H46 B Cl O3 Os P2 -","- C100 H184 B4 Cl4 O12 Os4 P8 -","4","1","","Esteruelas, Miguel A.; Fernández, Israel; López, Ana M.; Mora, Malka; Oñate, Enrique","Preparation, Structure, Bonding, and Preliminary Reactivity of a Six-Coordinate d4Osmium‒Boryl Complex","Organometallics","2012","31","13","4646","","10.1021/om300407d","","","0.71073","MoKα","","0.1107","0.051","","","0.0921","0.1148","","","","","","0.967","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078771","9.4821","0.0008","11.2068","0.001","25.015","0.002","78.843","0.002","89.461","0.002","83.898","0.002","2593","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H15 F35 Mo N O2 -","- C57 H15 F35 Mo N O2 -","- C114 H30 F70 Mo2 N2 O4 -","2","1","","Yuan, Jian; Schrock, Richard R.; Müller, Peter; Axtell, Jonathan C.; Dobereiner, Graham E.","Pentafluorophenylimido Alkylidene Complexes of Molybdenum and Tungsten","Organometallics","2012","31","13","4650","","10.1021/om300408n","","","0.71073","MoKα","","0.0506","0.0384","","","0.0875","0.0938","","","","","","1.036","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078772","6.5813","0.0003","17.0135","0.0008","21.0551","0.0009","90","","98.086","0.001","90","","2334.12","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H6 F23 N O2 W -","- C17 H6 F23 N O2 W -","- C68 H24 F92 N4 O8 W4 -","4","1","","Yuan, Jian; Schrock, Richard R.; Müller, Peter; Axtell, Jonathan C.; Dobereiner, Graham E.","Pentafluorophenylimido Alkylidene Complexes of Molybdenum and Tungsten","Organometallics","2012","31","13","4650","","10.1021/om300408n","","","0.71073","MoKα","","0.0244","0.0175","","","0.0377","0.041","","","","","","1.075","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078773","22.0127","0.0011","15.2586","0.0008","13.9366","0.0007","90","","92.85","0.001","90","","4675.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H18 F25 Mo N O2 -","- C52 H18 F25 Mo N O2 -","- C208 H72 F100 Mo4 N4 O8 -","4","1","","Yuan, Jian; Schrock, Richard R.; Müller, Peter; Axtell, Jonathan C.; Dobereiner, Graham E.","Pentafluorophenylimido Alkylidene Complexes of Molybdenum and Tungsten","Organometallics","2012","31","13","4650","","10.1021/om300408n","","","0.71073","MoKα","","0.0297","0.0249","","","0.0647","0.0678","","","","","","1.035","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4078774","14.6858","0.0005","11.9415","0.0005","14.7634","0.0004","90","","110.884","0.002","90","","2418.97","0.15","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","μ^2^-[2,5-Bis(ethoxymethylidenyl)thiophene]decacarbonylditungsten","","- C20 H12 O12 S W2 -","- C20 H12 O12 S W2 -","- C80 H48 O48 S4 W8 -","4","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0557","0.0321","","","0.0577","0.065","","","","","","1.084","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078775","11.752","0.002","14.931","0.003","19.287","0.004","90","","90","","90","","3384.3","1.1","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Tetracarbonyl-2,3-bis(ethoxymethylidenyl)-5-methyl-thiophene- chromium(0)","2,2,2,2-Tetracarbonyl-1,3-diethoxy-2- chroma(0)-5-methylcyclopentatrieno[b]thiophene","","- C15 H14 Cr O6 S -","- C15 H14 Cr O6 S -","- C120 H112 Cr8 O48 S8 -","8","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0473","0.0328","","","0.0776","0.084","","","","","","1.053","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078776","7.2106","0.0005","26.1162","0.0016","9.9037","0.0006","90","","103.189","0.001","90","","1815.8","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2,3-Di(ethoxymethylidenyl)-benzothiophene](tetracarbonyl) chromium","","- C18 H14 Cr O6 S -","- C18 H14 Cr O6 S -","- C72 H56 Cr4 O24 S4 -","4","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0324","0.0274","","","0.0727","0.0751","","","","","","1.071","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078777","7.2201","0.0003","26.3987","0.0009","10.0133","0.0004","90","","102.772","0.001","90","","1861.33","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[2,3-Di(ethoxymethylidenyl)-benzothiophene](tetracarbonyl) tungsten","","- C18 H14 O6 S W -","- C18 H14 O6 S W -","- C72 H56 O24 S4 W4 -","4","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0239","0.02","","","0.0392","0.0402","","","","","","1.085","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078778","23.6393","0.0007","7.5262","0.0003","9.187","0.0003","90","","90","","90","","1634.5","0.1","183","2","183","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","[2-(Ethoxymethylidenyl)-4-methyl-4-<i>H</i>-thienopyrrole](pentacarbonyl) chromium","","- C15 H11 Cr N O6 S -","- C15 H11 Cr N O6 S -","- C60 H44 Cr4 N4 O24 S4 -","4","0.5","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0501","0.039","","","0.1151","0.1195","","","","","","1.007","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078779","7.1651","0.0004","11.4198","0.0007","11.8024","0.0007","65.739","0.003","82.524","0.003","73.027","0.003","842.02","0.09","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","[2-(Ethoxymethylidenyl)-4-methyl-4-<i>H</i>-thienopyrrole](pentacarbonyl) tungsten","","- C15 H11 N O6 S W -","- C15 H11 N O6 S W -","- C30 H22 N2 O12 S2 W2 -","2","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.04","0.0315","","","0.0617","0.0627","","","","","","0.944","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078780","7.2443","0.0003","18.7946","0.0009","20.0564","0.0005","85.341","0.003","89.251","0.003","83.935","0.003","2706.47","0.19","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","[2,3-Di(ethoxymethylidenyl)-4-methyl-4-<i>H</i>-thienopyrrole](tetracarbonyl) chromium","","- C17 H15 Cr N O6 S -","- C17 H15 Cr N O6 S -","- C102 H90 Cr6 N6 O36 S6 -","6","3","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0935","0.0451","","","0.093","0.1006","","","","","","0.856","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078781","10.7349","0.0003","7.2361","0.0002","23.4138","0.0005","90","","94.075","0.002","90","","1814.16","0.08","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[2,3-Di(ethoxymethylidenyl)-4-methyl-4-<i>H</i>-thienopyrrole](tetracarbonyl) tungsten","","- C17 H15 N O6 S W -","- C17 H15 N O6 S W -","- C68 H60 N4 O24 S4 W4 -","4","1","","Lotz, Simon; van Jaarsveld, Nina A.; Liles, David C.; Crause, Chantelle; Görls, Helmar; Terblans, Yvette M.","Fischer Dinuclear and Mononuclear Bis-Carbene Complexes of Thiophene and Thiophene Derivatives","Organometallics","2012","31","15","5371","","10.1021/om300414y","","","0.71073","MoKα","","0.0408","0.0324","","","0.0792","0.0807","","","","","","1.041","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078782","20.9687","0.0018","22.0733","0.0019","9.3097","0.0008","90","","90","","90","","4309","0.6","125","2","125","2","","","","","","","","4","P n n 2","P 2 -2n","34","","","","- C46 H54 As2 Zr -","- C46 H54 As2 Zr -","- C184 H216 As8 Zr4 -","4","1","","Elrod, L. Taylor; Boxwala, Hussain; Haq, Hira; Zhao, Annie W.; Waterman, Rory","As‒As Bond Formation via Reductive Elimination from a Zirconocene Bis(dimesitylarsenide) Compound","Organometallics","2012","31","14","5204","","10.1021/om300415q","","","0.71073","MoKα","","0.0279","0.0254","","","0.063","0.0639","","","","","","1.042","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078783","8.523","0.005","17.128","0.009","18.972","0.011","90","","95.871","0.005","90","","2755","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 Fe2 O6 P S2 -","- C27 H21 Fe2 O6 P S2 -","- C108 H84 Fe8 O24 P4 S8 -","4","1","","Song, Li-Cheng; Wang, Liang-Xing; Jia, Guo-Jun; Li, Qian-Li; Ming, Jiang-Bo","Synthesis, Structural Characterization, and Properties of Some Functionalized Phosphine-Containing Diiron Complexes As Models for the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","14","5081","","10.1021/om300418z","","","0.7107","MoKα","","0.07","0.0539","","","0.1463","0.1598","","","","","","0.94","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078784","15.0944","0.0006","8.8897","0.0003","46.427","0.002","90","","97.235","0.002","90","","6180.2","0.4","113","2","113","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C66 H49 Cl4 Fe2 N4 O5 P S2 -","- C66 H49 Cl4 Fe2 N4 O5 P S2 -","- C264 H196 Cl16 Fe8 N16 O20 P4 S8 -","4","1","","Song, Li-Cheng; Wang, Liang-Xing; Jia, Guo-Jun; Li, Qian-Li; Ming, Jiang-Bo","Synthesis, Structural Characterization, and Properties of Some Functionalized Phosphine-Containing Diiron Complexes As Models for the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","14","5081","","10.1021/om300418z","","","0.7107","MoKα","","0.0857","0.0734","","","0.1683","0.1773","","","","","","1.12","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078785","12.102","0.002","14.449","0.003","17.298","0.003","78.937","0.005","85.694","0.006","86.281","0.005","2956.2","0.9","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C71 H52 Fe2 N5 O7 P S2 -","- C71 H52 Fe2 N5 O7 P S2 -","- C142 H104 Fe4 N10 O14 P2 S4 -","2","1","","Song, Li-Cheng; Wang, Liang-Xing; Jia, Guo-Jun; Li, Qian-Li; Ming, Jiang-Bo","Synthesis, Structural Characterization, and Properties of Some Functionalized Phosphine-Containing Diiron Complexes As Models for the Active Site of [FeFe]-Hydrogenases","Organometallics","2012","31","14","5081","","10.1021/om300418z","","","0.7107","MoKα","","0.1266","0.0742","","","0.1455","0.1743","","","","","","1.05","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078786","11.0441","0.0002","15.0942","0.0003","17.8573","0.0004","69.8435","0.0009","85.4295","0.0011","89.9816","0.0012","2784.47","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C53.5 H70.25 I2 N6.75 Rh2 -","- C53.5 H70.25 I2 N6.75 Rh2 -","- C107 H140.5 I4 N13.5 Rh4 -","2","1","","Zamora, Matthew T.; Ferguson, Michael J.; Cowie, Martin","Di-Mesoionic Carbene-Bridged Complexes of Rh2, Ir2, and RhIr: A Stepwise Metalation Strategy for the Synthesis of di-MIC-Bridged Mixed-Metal Systems","Organometallics","2012","31","15","5384","","10.1021/om300423z","","","1.54178","CuKα","","0.0805","0.0704","","","0.1631","0.1732","","","","","","1.05","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078787","7.6028","0.0003","8.6374","0.0003","10.072","0.0002","105.309","0.002","90.376","0.002","111.183","0.002","591","0.04","298","2","298","2","","","","","","","","5","P -1","-P 1","2","thionalidixic acid","1-Ehyl-7-methyl-4-thioxo-1,4-dihydro-1,8-naphtyridine-3-carboxylic acid","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C24 H24 N4 O4 S2 -","2","1","","Hudej, Rosana; Kljun, Jakob; Kandioller, Wolfgang; Repnik, Urška; Turk, Boris; Hartinger, Christian G.; Keppler, Bernhard K.; Miklavčič, Damijan; Turel, Iztok","Synthesis and Biological Evaluation of the Thionated Antibacterial Agent Nalidixic Acid and Its Organoruthenium(II) Complex","Organometallics","2012","31","16","5867","","10.1021/om300424w","","","0.71073","MoKα","","0.0508","0.0423","","","0.1175","0.1256","","","","","","1.015","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078788","10.1963","0.0004","10.0836","0.0003","13.8054","0.0004","90","","105.716","0.001","90","","1366.34","0.08","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","thionalidixic acid ethyl ester","Ethyl 1-ethyl-7-methyl-4-thioxo-1,4-dihydro-1,8-naphtyridine-3-carboxylate","","- C14 H16 N2 O2 S -","- C14 H16 N2 O2 S -","- C56 H64 N8 O8 S4 -","4","1","","Hudej, Rosana; Kljun, Jakob; Kandioller, Wolfgang; Repnik, Urška; Turk, Boris; Hartinger, Christian G.; Keppler, Bernhard K.; Miklavčič, Damijan; Turel, Iztok","Synthesis and Biological Evaluation of the Thionated Antibacterial Agent Nalidixic Acid and Its Organoruthenium(II) Complex","Organometallics","2012","31","16","5867","","10.1021/om300424w","","","0.71073","MoKα","","0.062","0.0404","","","0.0915","0.101","","","","","","1.024","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078789","12.2776","0.0004","13.2829","0.0006","12.8789","0.0005","90","","90.893","0.002","90","","2100.06","0.14","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[Chlorido(η^6^-p-cymene)(thionalidixicato-κ^2^S,O)ruthenium(II)]","[Chlorido(η^6^-p-ispropyltoluene)(1-ethyl-7-methyl-4-thioxo-1,4-dihydro- 1,8-naphthyridine-3-carboxylato-κ^2^S,O)ruthenium(II)]","","- C22 H25 Cl N2 O2 Ru S -","- C22 H25 Cl N2 O2 Ru S -","- C88 H100 Cl4 N8 O8 Ru4 S4 -","4","1","","Hudej, Rosana; Kljun, Jakob; Kandioller, Wolfgang; Repnik, Urška; Turk, Boris; Hartinger, Christian G.; Keppler, Bernhard K.; Miklavčič, Damijan; Turel, Iztok","Synthesis and Biological Evaluation of the Thionated Antibacterial Agent Nalidixic Acid and Its Organoruthenium(II) Complex","Organometallics","2012","31","16","5867","","10.1021/om300424w","","","0.71073","MoKα","","0.0872","0.0499","","","0.0954","0.1053","","","","","","1.287","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078790","4.6074","0.0003","13.4742","0.0006","20.3128","0.001","90","","96.485","0.005","90","","1252.97","0.12","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","nalidixic acid ethyl ester","ethyl 1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","","Hudej, Rosana; Kljun, Jakob; Kandioller, Wolfgang; Repnik, Urška; Turk, Boris; Hartinger, Christian G.; Keppler, Bernhard K.; Miklavčič, Damijan; Turel, Iztok","Synthesis and Biological Evaluation of the Thionated Antibacterial Agent Nalidixic Acid and Its Organoruthenium(II) Complex","Organometallics","2012","31","16","5867","","10.1021/om300424w","","","0.71073","MoKα","","0.0578","0.0446","","","0.1199","0.1314","","","","","","1.018","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078791","6.1229","0.0002","16.9983","0.0011","10.3946","0.0006","90","","98.354","0.003","90","","1070.38","0.1","173","2","173","2","","","","","","","","7","P 1 21 1","P 2yb","4","ItBuAuNtf2","","","- C13 H20 Au F6 N3 O4 S2 -","- C13 H20 Au F6 N3 O4 S2 -","- C26 H40 Au2 F12 N6 O8 S4 -","2","1","","Jacques, Béatrice; Kirsch, Jonathan; de Frémont, Pierre; Braunstein, Pierre","NHC Gold(III) Triflimidate Complexes","Organometallics","2012","31","13","4654","","10.1021/om3004256","","x-ray","0.71073","MoKα","","0.0502","0.0401","","","0.0885","0.0928","","","","","","1.007","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078792","11.3435","0.0003","18.8852","0.0007","22.3377","0.0008","67.794","0.001","75.838","0.002","89.662","0.002","4275.7","0.3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","IPrAuCl2NtF2","IPrAuCl2NtF2","","- C29 H36 Au Cl2 F6 N3 O4 S2 -","- C29 H36 Au Cl2 F6 N3 O4 S2 -","- C116 H144 Au4 Cl8 F24 N12 O16 S8 -","4","2","","Jacques, Béatrice; Kirsch, Jonathan; de Frémont, Pierre; Braunstein, Pierre","NHC Gold(III) Triflimidate Complexes","Organometallics","2012","31","13","4654","","10.1021/om3004256","","x-ray","0.71073","MoKα","","0.0836","0.0506","","","0.121","0.1309","","","","","","0.941","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078793","11.252","0.005","11.936","0.005","17.823","0.005","79.81","0.005","82.054","0.005","89.142","0.005","2333.2","1.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","ItBuAuCl2Ntf2","","","- C13 H20 Au Cl2 F6 N3 O4 S2 -","- C13 H20 Au Cl2 F6 N3 O4 S2 -","- C52 H80 Au4 Cl8 F24 N12 O16 S8 -","4","2","","Jacques, Béatrice; Kirsch, Jonathan; de Frémont, Pierre; Braunstein, Pierre","NHC Gold(III) Triflimidate Complexes","Organometallics","2012","31","13","4654","","10.1021/om3004256","","x-ray","0.71069","MoKα","","0.1182","0.0516","","","0.1092","0.1486","","","","","","0.974","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078794","10.921","0.005","12.881","0.005","13.761","0.005","115.457","0.005","106.837","0.005","91.761","0.005","1645.7","1.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","(ItBu)2AuNtf2","","","- C24 H40 Au F6 N5 O4 S2 -","- C24 H40 Au F6 N5 O4 S2 -","- C48 H80 Au2 F12 N10 O8 S4 -","2","1","","Jacques, Béatrice; Kirsch, Jonathan; de Frémont, Pierre; Braunstein, Pierre","NHC Gold(III) Triflimidate Complexes","Organometallics","2012","31","13","4654","","10.1021/om3004256","","x-ray","0.71069","MoKα","","0.0465","0.0367","","","0.0927","0.1173","","","","","","1.085","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078795","6.841","0.0003","16.0925","0.0007","12.902","0.0005","90","","103.221","0.002","90","","1382.72","0.1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H27 N3 Pd -","- C11.001 H27.003 N3.001 Pd -","- C44.004 H108.012 N12.004 Pd4 -","4","1","","Khusnutdinova, Julia R.; Qu, Fengrui; Zhang, Ying; Rath, Nigam P.; Mirica, Liviu M.","Formation of the Palladium(IV) Complex [(Me3tacn)PdIVMe3]+through Aerobic Oxidation of (Me3tacn)PdIIMe2(Me3tacn =N,N′,N″-Trimethyl-1,4,7-triazacyclononane)","Organometallics","2012","31","13","4627","","10.1021/om300426r","","","0.71073","MoKα","","0.0428","0.0343","","","0.068","0.0742","","","","","","1.116","","","","has coordinates,has disorder","178676","2020-10-21","18:00:00",""
"4078796","9.0285","0.0006","13.3794","0.0009","13.7845","0.001","90","","91.138","0.003","90","","1664.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H30 I N3 Pd -","- C12 H30 I N3 Pd -","- C48 H120 I4 N12 Pd4 -","4","1","","Khusnutdinova, Julia R.; Qu, Fengrui; Zhang, Ying; Rath, Nigam P.; Mirica, Liviu M.","Formation of the Palladium(IV) Complex [(Me3tacn)PdIVMe3]+through Aerobic Oxidation of (Me3tacn)PdIIMe2(Me3tacn =N,N′,N″-Trimethyl-1,4,7-triazacyclononane)","Organometallics","2012","31","13","4627","","10.1021/om300426r","","","0.71073","MoKα","","0.0341","0.0225","","","0.0448","0.0488","","","","","","1.013","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4078797","7.8676","0.0008","9.1352","0.0007","16.2751","0.0009","80.102","0.004","80.818","0.005","88.077","0.004","1137.53","0.16","200","","200","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H25 Cr N O4 Si -","- C21 H25 Cr N O4 Si -","- C42 H50 Cr2 N2 O8 Si2 -","2","1","","Ylijoki, Kai E. O.; Lavy, Séverine; Fretzen, Angelika; Kündig, E. Peter; Berclaz, Théo; Bernardinelli, Gérald; Besnard, Céline","A Synthetic and Mechanistic Investigation of the Chromium Tricarbonyl-Mediated Masamune‒Bergman Cyclization. Direct Observation of a Ground-State Tripletp-Benzyne Biradical","Organometallics","2012","31","15","5396","","10.1021/om300427j","","","1.54183","CuKα","","","0.042","","","","0.037","","","","","","1.137","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078798","10.3241","0.0007","15.1982","0.0009","13.3413","0.001","90","","94.973","0.006","90","","2085.5","0.2","220","","220","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Cr O4 Si -","- C22 H24 Cr O4 Si -","- C88 H96 Cr4 O16 Si4 -","4","1","","Ylijoki, Kai E. O.; Lavy, Séverine; Fretzen, Angelika; Kündig, E. Peter; Berclaz, Théo; Bernardinelli, Gérald; Besnard, Céline","A Synthetic and Mechanistic Investigation of the Chromium Tricarbonyl-Mediated Masamune‒Bergman Cyclization. Direct Observation of a Ground-State Tripletp-Benzyne Biradical","Organometallics","2012","31","15","5396","","10.1021/om300427j","","","0.71073","MoKα","","0.0473","0.0392","","0.0481","0.0474","0.048","","","","","","1.7554","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078799","8.5358","0.0004","18.1171","0.0007","15.3207","0.0006","90","","100.552","0.0014","90","","2329.19","0.17","123","2","123","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H36 Cl Si2 Ta -","- C18 H36 Cl Si2 Ta -","- C72 H144 Cl4 Si8 Ta4 -","4","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0289","0.0252","","","0.0561","0.0581","","","","","","1.035","","","","has coordinates","178676","2020-10-21","18:00:00",""
"4078800","10.4698","0.0007","17.0104","0.0009","18.3434","0.0009","90","","90","","90","","3266.9","0.3","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H54 Ir Si2 Ta -","- C28 H54 Ir Si2 Ta -","- C112 H216 Ir4 Si8 Ta4 -","4","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.031","0.0289","","","0.066","0.0672","","","","","","1.05","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078801","17.873","0.0007","11.1005","0.0005","27.0007","0.0009","90","","90","","90","","5356.9","0.4","123","2","123","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C48 H88 Ir2 O2 Si2 Ta2 -","- C48 H37 Ir2 O2 Si2 Ta2 -","- C192 H148 Ir8 O8 Si8 Ta8 -","4","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.074","0.0594","","","0.1432","0.1534","","","","","","1.048","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078802","10.4796","0.0009","11.7018","0.001","17.459","0.0014","89.452","0.003","85.406","0.003","66.811","0.003","1961.1","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H64 Ir2 Ta2 -","- C40 H49 Ir2 Ta2 -","- C80 H98 Ir4 Ta4 -","2","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0797","0.0548","","","0.1149","0.1373","","","","","","1.089","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078803","15.1581","0.0004","17.6572","0.0006","22.6264","0.0007","90","","98.586","0.001","90","","5988.1","0.3","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H51 Ir N Si Ta -","- C27 H27 Ir N Si Ta -","- C216 H216 Ir8 N8 Si8 Ta8 -","8","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0325","0.0295","","","0.0721","0.0738","","","","","","1.041","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078804","15.0774","0.0004","21.5886","0.0005","20.021","0.0006","90","","107.648","0.0009","90","","6210.1","0.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H49 Ir N Si Ta -","- C30 H49 Ir N Si Ta -","- C240 H392 Ir8 N8 Si8 Ta8 -","8","2","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0379","0.0274","","","0.0564","0.0596","","","","","","1.028","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078805","15.1736","0.0004","21.9593","0.0005","20.0407","0.0005","90","","106.27","0.0008","90","","6410.2","0.3","123","2","123","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H48 Br Ir N Si Ta -","- C30 H48 Br Ir N Si Ta -","- C240 H384 Br8 Ir8 N8 Si8 Ta8 -","8","2","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0546","0.0358","","","0.0612","0.0661","","","","","","0.977","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078806","10.512","0.0005","11.1074","0.0006","13.3546","0.0008","86.942","0.0018","86.578","0.0016","87.173","0.0016","1552.63","0.15","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H52 Ir O Si Ta -","- C28 H17 Ir O Si Ta -","- C56 H34 Ir2 O2 Si2 Ta2 -","2","1","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.1123","0.0771","","","0.1904","0.2352","","","","","","1.145","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078807","11.0541","0.0004","18.6809","0.0007","15.6814","0.0007","90","","94.683","0.0014","90","","3227.4","0.2","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H40 Br2 Ir O2 Ta -","- C32 H40 Br2 Ir O2 Ta -","- C128 H160 Br8 Ir4 O8 Ta4 -","4","2","","Oishi, Masataka; Kino, Masashi; Saso, Masayuki; Oshima, Masato; Suzuki, Hiroharu","Early‒Late Heterobimetallic Complexes with a Ta‒Ir Multiple Bond: Bimetallic Oxidative Additions of C‒H, N‒H, and O‒H Bonds","Organometallics","2012","31","13","4658","","10.1021/om300429u","","","0.71069","MoKα","","0.0407","0.0359","","","0.0698","0.0727","","","","","","0.938","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078808","12.7626","0.0019","13.559","0.002","14.789","0.002","80.15","0.004","71.462","0.003","66.438","0.003","2221.3","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H64 Cl2 Li N4 O3 Y -","- C44 H64 Cl2 Li N4 O3 Y -","- C88 H128 Cl4 Li2 N8 O6 Y2 -","2","1","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.2126","0.0796","","","0.1369","0.1663","","","","","","0.866","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078809","33.2595","0.0018","13.9049","0.0004","20.5482","0.001","90","","122.595","0.007","90","","8006.2","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H60 Cl Lu N4 O2.5 -","- C42 H60 Cl Lu N4 O2.5 -","- C336 H480 Cl8 Lu8 N32 O20 -","8","1","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.0486","0.0354","","","0.0782","0.0843","","","","","","1.111","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078810","10.3374","0.0004","19.4923","0.0008","26.3232","0.0011","90","","100.236","0.001","90","","5219.7","0.4","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H80 Cl2 Li N4 O3 Y -","- C52 H80 Cl2 Li N4 O3 Y -","- C208 H320 Cl8 Li4 N16 O12 Y4 -","4","1","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.0628","0.0406","","","0.0915","0.0984","","","","","","1.046","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078811","11.4232","0.0004","20.2912","0.0007","17.2321","0.0006","90","","93.492","0.001","90","","3986.8","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H59 N4 O Si Y -","- C40 H59 N4 O Si Y -","- C160 H236 N16 O4 Si4 Y4 -","4","1","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.0657","0.0447","","","0.1133","0.1217","","","","","","1.045","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078812","12.833","0.002","16.95","0.002","18.4991","0.0016","92.933","0.004","91.098","0.002","91.082","0.004","4017.1","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H59 Lu N4 O Si -","- C40 H59 Lu N4 O Si -","- C160 H236 Lu4 N16 O4 Si4 -","4","2","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.0954","0.049","","","0.0921","0.0982","","","","","","1.018","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078813","30.5945","0.0013","22.7252","0.001","33.2068","0.0014","90","","105.751","0.001","90","","22220.6","1.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C122 H164 N8 O4 Y2 -","- C122 H164 N8 O4 Y2 -","- C976 H1312 N64 O32 Y16 -","8","1","","Tolpygin, Aleksei O.; Shavyrin, Andrei S.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Chloro and Alkyl Rare-Earth Complexes Supported byansa-Bis(amidinate) Ligands with a Rigido-Phenylene Linker. Ligand Steric Bulk: A Means of Stabilization or Destabilization?","Organometallics","2012","31","15","5405","","10.1021/om3004306","","","0.71073","MoKα","","0.1761","0.0778","","","0.1555","0.1784","","","","","","1.006","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078814","12.2684","0.001","26.237","0.002","19.6275","0.0016","90","","102.51","0.002","90","","6167.8","0.9","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H38 Au2 N4 -","- C33 H38 Au2 N4 -","- C264 H304 Au16 N32 -","8","2","","Gil-Rubio, Juan; Cámara, Verónica; Bautista, Delia; Vicente, José","Dinuclear Alkynyl Gold(I) Complexes Containing Bridging N-Heterocyclic Dicarbene Ligands: New Synthetic Routes and Luminescence","Organometallics","2012","31","15","5414","","10.1021/om300431r","","","0.71073","MoKα","","0.0437","0.034","","","0.0641","0.0671","","","","","","1.053","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078815","20.9777","0.0016","10.5329","0.0008","31.728","0.002","90","","91.891","0.002","90","","7006.7","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H36 Au2 Cl2 N4 -","- C17 H36 Au2 Cl2 N4 -","- C204 H432 Au24 Cl24 N48 -","12","3","","Gil-Rubio, Juan; Cámara, Verónica; Bautista, Delia; Vicente, José","Dinuclear Alkynyl Gold(I) Complexes Containing Bridging N-Heterocyclic Dicarbene Ligands: New Synthetic Routes and Luminescence","Organometallics","2012","31","15","5414","","10.1021/om300431r","","","0.71073","MoKα","","0.0314","0.0266","","","0.053","0.0546","","","","","","1.094","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078816","11.3227","0.0005","17.3114","0.001","24.5617","0.0011","90","","95.2165","0.001","90","","4794.4","0.4","113.1","","113.1","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C57.5 H54 Cl N P4 W -","- C57.5 H50 Cl N P4 W -","- C230 H200 Cl4 N4 P16 W4 -","4","1","","Dai, Qi Xiu; Seino, Hidetake; Mizobe, Yasushi","Tungsten(II) Alkylimido Complexes from Insertion of Nitriles into Tungsten Hydride: Alkylideneamido Intermediate Stage and Nitrene Group Transfer to Isocyanide","Organometallics","2012","31","14","4933","","10.1021/om3004338","","","0.7107","MoKα","","","0.0281","","","","0.06","","","","","","1.004","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078817","17.067","0.003","17.728","0.003","33.616","0.005","90","","90","","90","","10171","3","113.1","","113.1","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C61 H59 N P4 W -","- C61 H59 N P4 W -","- C488 H472 N8 P32 W8 -","8","1","","Dai, Qi Xiu; Seino, Hidetake; Mizobe, Yasushi","Tungsten(II) Alkylimido Complexes from Insertion of Nitriles into Tungsten Hydride: Alkylideneamido Intermediate Stage and Nitrene Group Transfer to Isocyanide","Organometallics","2012","31","14","4933","","10.1021/om3004338","","","0.7107","MoKα","","","0.0402","","","","0.0929","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078818","18.834","0.005","10.813","0.003","25.316","0.007","90","","99.2664","0.0011","90","","5088","2","113.1","","113.1","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C61 H59 N P4 W -","- C61 H59 N P4 W -","- C244 H236 N4 P16 W4 -","4","1","","Dai, Qi Xiu; Seino, Hidetake; Mizobe, Yasushi","Tungsten(II) Alkylimido Complexes from Insertion of Nitriles into Tungsten Hydride: Alkylideneamido Intermediate Stage and Nitrene Group Transfer to Isocyanide","Organometallics","2012","31","14","4933","","10.1021/om3004338","","","0.7107","MoKα","","","0.0215","","","","0.0442","","","","","","1.042","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4078819","11.1458","0.0007","12.3496","0.0008","14.1942","0.001","86.394","0.005","75.615","0.005","75.546","0.005","1832.6","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H37 Cl2 N O P2 Ru -","- C44 H37 Cl2 N O P2 Ru -","- C88 H74 Cl4 N2 O2 P4 Ru2 -","2","1","","Ardizzoia, G. Attilio; Brenna, Stefano; Durini, Sara; Therrien, Bruno","Ruthenium(II) Complexes Bearing a Ligand Derived fromP,N- orP,N,O-Diphenylphosphinobenzoxazine: Synthesis, X-ray Characterization, andcisDiastereoselectivity in Styrene Cyclopropanation","Organometallics","2012","31","15","5427","","10.1021/om300434u","","","0.71073","MoKα","","0.1419","0.0671","","","0.0752","0.0886","","","","","","0.925","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078820","11.9642","0.0008","9.9035","0.0006","37.701","0.003","90","","102.818","0.006","90","","4355.8","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H41 Cl6 N O P2 Ru -","- C46 H41 Cl6 N O P2 Ru -","- C184 H164 Cl24 N4 O4 P8 Ru4 -","4","1","","Ardizzoia, G. Attilio; Brenna, Stefano; Durini, Sara; Therrien, Bruno","Ruthenium(II) Complexes Bearing a Ligand Derived fromP,N- orP,N,O-Diphenylphosphinobenzoxazine: Synthesis, X-ray Characterization, andcisDiastereoselectivity in Styrene Cyclopropanation","Organometallics","2012","31","15","5427","","10.1021/om300434u","","","0.71073","MoKα","","0.2826","0.1244","","","0.1459","0.1901","","","","","","0.961","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078821","10.1641","0.0006","10.2585","0.0006","16.5236","0.001","74.473","0.005","78.171","0.005","71.912","0.004","1563.94","0.17","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H34 Cl2 N O5 P Ru -","- C34 H34 Cl2 N O5 P Ru -","- C68 H68 Cl4 N2 O10 P2 Ru2 -","2","1","","Ardizzoia, G. Attilio; Brenna, Stefano; Durini, Sara; Therrien, Bruno","Ruthenium(II) Complexes Bearing a Ligand Derived fromP,N- orP,N,O-Diphenylphosphinobenzoxazine: Synthesis, X-ray Characterization, andcisDiastereoselectivity in Styrene Cyclopropanation","Organometallics","2012","31","15","5427","","10.1021/om300434u","","","0.71073","MoKα","","0.1192","0.0683","","","0.1259","0.1423","","","","","","0.988","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078822","15.72","0.003","19.209","0.003","15.795","0.003","90","","105.511","0.003","90","","4595.8","1.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C55 H42 Cl3 N4 Rh -","- C55 H42 Cl3 N4 Rh -","- C220 H168 Cl12 N16 Rh4 -","4","1","","Qian, Ying Ying; Chan, Kin Shing","Base-Promoted Aryl Carbon‒Iodine and Carbon‒Bromine Bond Cleavage with Rhodium Porphyrin Complexes: Scope and Mechanism","Organometallics","2012","31","15","5452","","10.1021/om300441p","","","0.71073","MoKα","","0.0865","0.0731","","","0.2016","0.2218","","","","","","1.063","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078823","12.243","0.003","16.532","0.003","23.872","0.005","90","","101.854","0.004","90","","4728.7","1.8","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H44 Br N4 O Rh -","- C55 H44 Br N4 O Rh -","- C220 H176 Br4 N16 O4 Rh4 -","4","1","","Qian, Ying Ying; Chan, Kin Shing","Base-Promoted Aryl Carbon‒Iodine and Carbon‒Bromine Bond Cleavage with Rhodium Porphyrin Complexes: Scope and Mechanism","Organometallics","2012","31","15","5452","","10.1021/om300441p","","","0.71073","MoKα","","0.1484","0.0784","","","0.2205","0.2885","","","","","","1.03","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078824","6.9005","0.0014","6.3367","0.0013","20.75","0.004","90","","99.38","0.03","90","","895.2","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H28 N2 O7 Si -","- C12 H28 N2 O7 Si -","- C24 H56 N4 O14 Si2 -","2","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0572","0.0419","","","0.1019","0.1132","","","","","","0.972","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078825","5.8981","0.0003","10.9256","0.0006","29.657","0.0016","90","","90","","90","","1911.11","0.18","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H25 F3 N2 O7 Si -","- C14 H25 F3 N2 O7 Si -","- C56 H100 F12 N8 O28 Si4 -","4","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0298","0.0273","","","0.0689","0.0704","","","","","","1.039","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078826","13.1285","0.001","6.5496","0.0005","13.9228","0.001","90","","101.227","0.003","90","","1174.26","0.15","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H36 N2 O6 Si -","- C17 H36 N2 O6 Si -","- C34 H72 N4 O12 Si2 -","2","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0303","0.0285","","","0.0753","0.0768","","","","","","1.036","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078827","11.5958","0.0011","36.009","0.004","5.8328","0.0005","90","","90","","90","","2435.5","0.4","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C18 H41 N2 O7.5 Si -","- C18 H41 N2 O7.5 Si -","- C72 H164 N8 O30 Si4 -","4","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0246","0.0239","","","0.0675","0.0679","","","","","","1.125","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078828","9.1765","0.0018","10.3293","0.0016","15.134","0.003","90","","97.75","0.02","90","","1421.4","0.5","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C8 H20 Cl N O2 Si -","- C8 H20 Cl N O2 Si -","- C32 H80 Cl4 N4 O8 Si4 -","4","2","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0686","0.0446","","","0.1016","0.1088","","","","","","0.906","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078829","5.9861","0.0006","11.3755","0.0013","19.498","0.002","90","","96.921","0.005","90","","1318","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H40 N2 O7 Si -","- C21 H40 N2 O7.225 Si -","- C42 H80 N4 O14.45 Si2 -","2","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0375","0.0336","","","0.0843","0.0864","","","","","","1.027","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078830","26.349","0.005","5.9675","0.0012","17.194","0.003","90","","95.25","0.009","90","","2692.2","0.9","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C22 H42 N2 O7 Si -","- C22 H42 N2 O7 Si -","- C88 H168 N8 O28 Si4 -","4","1","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0728","0.0669","","","0.1865","0.1903","","","","","","1.097","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078831","11.8973","0.0011","11.2852","0.0017","21.447","0.002","90","","100.233","0.012","90","","2833.7","0.6","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H38 N2 O7 Si -","- C24 H38 N2 O7 Si -","- C96 H152 N8 O28 Si4 -","4","2","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0891","0.0404","","","0.0892","0.106","","","","","","0.876","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078832","9.7202","0.0006","11.9718","0.0007","13.271","0.0008","80.868","0.003","76.542","0.003","67.524","0.003","1383.65","0.15","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C24 H38 N2 O7 Si -","- C24 H38 N2 O7 Si -","- C48 H76 N4 O14 Si2 -","2","2","","Dörrich, Steffen; Falgner, Steffen; Schweeberg, Sarah; Burschka, Christian; Brodin, Peter; Wissing, Britt Marie; Basta, Babro; Schell, Peter; Bauer, Udo; Tacke, Reinhold","Silicon-Containing Dipeptidic Aspartame and Neotame Analogues","Organometallics","2012","31","16","5903","","10.1021/om300442e","","","0.71073","MoKα","","0.0351","0.0322","","","0.0828","0.0853","","","","","","1.033","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078833","24.1086","0.0008","11.7699","0.0004","20.4463","0.0007","90","","111.65","0.0004","90","","5392.5","0.3","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H82 Al2 N2 Y2 -","- C44 H82 Al2 N2 Y2 -","- C176 H328 Al8 N8 Y8 -","4","0.5","","Schädle, Dorothea; Schädle, Christoph; Törnroos, Karl W.; Anwander, Reiner","Organoaluminum-Assisted Formation of Rare-Earth Metal Imide Complexes","Organometallics","2012","31","14","5101","","10.1021/om300443x","","","0.71073","MoKα","","0.0254","0.0227","","","0.0585","0.0605","","","","","","1.083","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078834","10.5291","0.0009","14.5921","0.0013","17.0337","0.0015","76.686","0.001","80.847","0.002","74.743","0.001","2443.4","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H82 Al2 La2 N2 -","- C44 H82 Al2 La2 N2 -","- C88 H164 Al4 La4 N4 -","2","1","","Schädle, Dorothea; Schädle, Christoph; Törnroos, Karl W.; Anwander, Reiner","Organoaluminum-Assisted Formation of Rare-Earth Metal Imide Complexes","Organometallics","2012","31","14","5101","","10.1021/om300443x","","","0.71073","MoKα","","0.0989","0.0495","","","0.0999","0.1165","","","","","","0.985","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078835","9.6377","0.0015","11.643","0.002","12.2647","0.0015","62.306","0.012","85.093","0.011","88.038","0.013","1214.1","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H82 Al2 N2 Nd2 -","- C44 H82 Al2 N2 Nd2 -","- C44 H82 Al2 N2 Nd2 -","1","0.5","","Schädle, Dorothea; Schädle, Christoph; Törnroos, Karl W.; Anwander, Reiner","Organoaluminum-Assisted Formation of Rare-Earth Metal Imide Complexes","Organometallics","2012","31","14","5101","","10.1021/om300443x","","","0.71073","MoKα","","0.0448","0.0359","","","0.079","0.0824","","","","","","1.041","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078836","23.9903","0.0009","11.7282","0.0005","20.4162","0.0008","90","","111.435","0.002","90","","5347","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H82 Al2 Lu2 N2 -","- C44 H82 Al2 Lu2 N2 -","- C176 H328 Al8 Lu8 N8 -","4","0.5","","Schädle, Dorothea; Schädle, Christoph; Törnroos, Karl W.; Anwander, Reiner","Organoaluminum-Assisted Formation of Rare-Earth Metal Imide Complexes","Organometallics","2012","31","14","5101","","10.1021/om300443x","","","0.71073","MoKα","","0.0216","0.0171","","","0.0372","0.0384","","","","","","1.065","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078837","10.5789","0.0008","8.7778","0.0007","12.9485","0.001","90","","91.434","0.002","90","","1202.01","0.16","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H16 Au Cl N2 -","- C11 H16 Au Cl N2 -","- C44 H64 Au4 Cl4 N8 -","4","1","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0527","0.0447","","","0.1151","0.1194","","","","","","1.052","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078838","11.046","0.0006","18.097","0.0011","29.2476","0.0017","90","","90","","90","","5846.6","0.6","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C26 H36 Au F6 N4 P -","- C26 H36 Au F6 N4 P -","- C208 H288 Au8 F48 N32 P8 -","8","0.25","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0288","0.026","","","0.0736","0.0749","","","","","","1.139","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078839","10.6027","0.0013","13.8516","0.0016","18.185","0.002","90","","102.706","0.002","90","","2605.3","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 Au F6 N4 P -","- C24 H34 Au F6 N4 P -","- C96 H136 Au4 F24 N16 P4 -","4","1","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0426","0.0349","","","0.0854","0.0999","","","","","","1.137","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078840","8.7682","0.0007","8.7682","0.0007","20.718","0.003","90","0","90","0","90","0","1592.8","0.3","100","2","100","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C13 H18 Au Cl3 N2 -","- C13 H18 Au Cl3 N2 -","- C52 H72 Au4 Cl12 N8 -","4","0.5","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0257","0.0248","","","0.0634","0.0636","","","","","","1.162","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078841","12.8544","0.0006","18.6376","0.0008","24.9384","0.0011","90","","90","","90","","5974.6","0.5","100","2","100","2","","","","","","","","7","F d d d :2","-F 2uv 2vw","70","","","","- C26 H36 Au Cl2 F6 N4 P -","- C26 H36 Au Cl2 F6 N4 P -","- C208 H288 Au8 Cl16 F48 N32 P8 -","8","0.25","","Sivaram, Haresh; Tan, Jackie; Huynh, Han Vinh","Syntheses, Characterizations, and a Preliminary Comparative Cytotoxicity Study of Gold(I) and Gold(III) Complexes Bearing Benzimidazole- and Pyrazole-Derived N-Heterocyclic Carbenes","Organometallics","2012","31","16","5875","","10.1021/om300444c","","","0.71073","MoKα","","0.0179","0.0162","","","0.0397","0.0407","","","","","","1.075","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078842","9.777","0.0011","12.001","0.0014","15.993","0.0014","71.639","0.011","75.339","0.012","88.962","0.014","1719.1","0.4","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H30 Fe2 N4 O6 S Sn -","- C35 H30 Fe2 N4 O6 S Sn -","- C70 H60 Fe4 N8 O12 S2 Sn2 -","2","1","","Liu, Xia-Li; Zhang, Xiao-Yan; Song, Hai-Bin; Tang, Liang-Fu","Reactivity of Bis(3,5-dimethylpyrazol-1-yl)methyllithium with S or CS2, Followed by Reaction with Fe3(CO)12and Ar3SnCl or RX: Unexpected Formation of (3,5-Dimethylpyrazol-1-yl)dithioformate Derivatives","Organometallics","2012","31","14","5108","","10.1021/om300448a","","","0.71075","MoKα","","0.0647","0.0483","","","0.0842","0.0922","","","","","","1.034","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078843","7.7591","0.0016","11.023","0.002","25.811","0.005","90","","95.64","0.03","90","","2196.9","0.7","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 Fe2 N2 O6 S2 -","- C19 H14 Fe2 N2 O6 S2 -","- C76 H56 Fe8 N8 O24 S8 -","4","1","","Liu, Xia-Li; Zhang, Xiao-Yan; Song, Hai-Bin; Tang, Liang-Fu","Reactivity of Bis(3,5-dimethylpyrazol-1-yl)methyllithium with S or CS2, Followed by Reaction with Fe3(CO)12and Ar3SnCl or RX: Unexpected Formation of (3,5-Dimethylpyrazol-1-yl)dithioformate Derivatives","Organometallics","2012","31","14","5108","","10.1021/om300448a","","","0.71073","MoKα","","0.0467","0.038","","","0.0884","0.094","","","","","","1.025","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078844","14.576","0.011","20.042","0.015","4.695","0.003","90","","90","","90","","1371.6","1.7","113","2","113","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C12 H20 N4 O2 -","- C12 H20 N4 O2 -","- C48 H80 N16 O8 -","4","0.5","","Liu, Xia-Li; Zhang, Xiao-Yan; Song, Hai-Bin; Tang, Liang-Fu","Reactivity of Bis(3,5-dimethylpyrazol-1-yl)methyllithium with S or CS2, Followed by Reaction with Fe3(CO)12and Ar3SnCl or RX: Unexpected Formation of (3,5-Dimethylpyrazol-1-yl)dithioformate Derivatives","Organometallics","2012","31","14","5108","","10.1021/om300448a","","","0.71073","MoKα","","0.0588","0.0539","","","0.1397","0.1441","","","","","","1.146","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078845","16.1666","0.001","9.6372","0.0006","15.9377","0.0012","90","","91.543","0.002","90","","2482.2","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H33 Fe N3 Si2 -","- C23 H33 Fe N3 Si2 -","- C92 H132 Fe4 N12 Si8 -","4","0.5","","Tondreau, Aaron M.; Atienza, Crisita Carmen Hojilla; Darmon, Jonathan M.; Milsmann, Carsten; Hoyt, Helen M.; Weller, Keith J.; Nye, Susan A.; Lewis, Kenrick M.; Boyer, Julie; Delis, Johannes G. P.; Lobkovsky, Emil; Chirik, Paul J.","Synthesis, Electronic Structure, and Alkene Hydrosilylation Activity of Terpyridine and Bis(imino)pyridine Iron Dialkyl Complexes","Organometallics","2012","31","13","4886","","10.1021/om3004527","","","0.71073","MoKα","","0.0351","0.027","","","0.0681","0.0741","","","","","","1.011","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078846","15.5497","0.0007","14.4945","0.0007","12.9298","0.0006","90","","102.301","0.0006","90","","2847.3","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 F6 N5 O6 S2 -","- C22 H29 F6 N5 O6 S2 -","- C88 H116 F24 N20 O24 S8 -","4","1","","Zamora, Matthew T.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Unsymmetrical Dicarbenes Based onN-Heterocyclic/Mesoionic Carbene Frameworks: A Stepwise Metalation Strategy for the Generation of a Dicarbene-Bridged Mixed-Metal Pd/Rh Complex","Organometallics","2012","31","15","5463","","10.1021/om3004543","","","0.71073","MoKα","","0.0471","0.0361","","","0.0892","0.0968","","","","","","1.021","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078847","10.1647","0.0005","10.4449","0.0005","13.1034","0.0006","76.462","0.0005","72.6898","0.0005","78.6303","0.0005","1279.03","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H30 I2 N5 O2 Rh -","- C22 H30 I2 N5 O2 Rh -","- C44 H60 I4 N10 O4 Rh2 -","2","1","","Zamora, Matthew T.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Unsymmetrical Dicarbenes Based onN-Heterocyclic/Mesoionic Carbene Frameworks: A Stepwise Metalation Strategy for the Generation of a Dicarbene-Bridged Mixed-Metal Pd/Rh Complex","Organometallics","2012","31","15","5463","","10.1021/om3004543","","","0.71073","MoKα","","0.02","0.0172","","","0.0424","0.0436","","","","","","1.036","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078848","30.695","0.019","17.496","0.011","15.149","0.009","90","","119.53","0.007","90","","7079","8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H40 I3 N9 Pd -","- C22 H31 I3 N6 Pd -","- C176 H248 I24 N48 Pd8 -","8","1","","Zamora, Matthew T.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Unsymmetrical Dicarbenes Based onN-Heterocyclic/Mesoionic Carbene Frameworks: A Stepwise Metalation Strategy for the Generation of a Dicarbene-Bridged Mixed-Metal Pd/Rh Complex","Organometallics","2012","31","15","5463","","10.1021/om3004543","","","0.71073","MoKα","","0.1091","0.0734","","","0.1986","0.2186","","","","","","1.08","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078849","13.782","0.003","15.694","0.003","22.394","0.005","79.906","0.003","88.01","0.003","86.666","0.003","4759.2","1.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H49 I3 N7 P Pd -","- C41 H47.5 I3 N6.5 P Pd -","- C164 H190 I12 N26 P4 Pd4 -","4","2","","Zamora, Matthew T.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin","Unsymmetrical Dicarbenes Based onN-Heterocyclic/Mesoionic Carbene Frameworks: A Stepwise Metalation Strategy for the Generation of a Dicarbene-Bridged Mixed-Metal Pd/Rh Complex","Organometallics","2012","31","15","5463","","10.1021/om3004543","","","0.71073","MoKα","","0.0509","0.0351","","","0.0862","0.0924","","","","","","1.031","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078850","9.554","0.0003","14.2139","0.0005","17.0434","0.0006","98.609","0.003","100.84","0.003","98.216","0.003","2212.43","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H40 Cl3 F2 Ir N7 -","- C45 H31 Cl F2 Ir N7 -","- C90 H62 Cl2 F4 Ir2 N14 -","2","1","","Wiegmann, Björn; Jones, Peter G.; Wagenblast, Gerhard; Lennartz, Christian; Münster, Ingo; Metz, Stefan; Kowalsky, Wolfgang; Johannes, Hans-Hermann","A New Framework of a Heteroleptic Iridium(III)‒Carbene Complex as a Triplet Emitting Material","Organometallics","2012","31","15","5223","","10.1021/om300458f","","","0.71073","MoKα","","0.0316","0.0263","","","0.059","0.0607","","","","","","1.042","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078851","12.0924","0.0004","17.7704","0.0005","15.3413","0.0005","90","","106.018","0.0007","90","","3168.66","0.17","123","","123","","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C26 H43 F5 N O P2 Si V -","- C26 H43 F5 N O P2 Si V -","- C104 H172 F20 N4 O4 P8 Si4 V4 -","4","2","","Nomura, Kotohiro; Suzuki, Ken; Katao, Shohei; Matsumoto, Yuichi","Ring-Opening Polymerization of THF by Aryloxo-Modified (Imido)vanadium(V)-alkyl Complexes and Ring-Opening Metathesis Polymerization by Highly Active V(CHSiMe3)(NAd)(OC6F5)(PMe3)2","Organometallics","2012","31","14","5114","","10.1021/om300463f","","","0.71075","MoKα","","","0.0517","","","","0.1361","","","","","","1.064","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078852","12.7835","0.0006","19.6275","0.0008","17.6761","0.0008","90","","102.418","0.001","90","","4331.3","0.3","223","2","223","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C47 H42 B Cl F4 N2 P2 Pd -","- C47 H42 B Cl F4 N2 P2 Pd -","- C188 H168 B4 Cl4 F16 N8 P8 Pd4 -","4","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0775","0.0546","","","0.1234","0.1339","","","","","","1.061","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078853","16.426","0.004","9.501","0.003","32.743","0.009","90","","90","","90","","5110","2","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H30 Br2 N4 Pd -","- C24 H30 Br2 N4 Pd -","- C192 H240 Br16 N32 Pd8 -","8","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0706","0.0489","","","0.1238","0.135","","","","","","1.04","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078854","7.429","0.0008","11.2598","0.0012","18.3","0.002","90","","98.965","0.002","90","","1512.1","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 Br2 N3 Pd -","- C13 H15 Br2 N3 Pd -","- C52 H60 Br8 N12 Pd4 -","4","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.025","0.0226","","","0.049","0.0493","","","","","","1.708","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078855","12.8293","0.0017","14.4879","0.0019","17.675","0.002","90","","101.964","0.002","90","","3213.9","0.7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30.5 H30 Br2 Cl3 N2 P Pd -","- C30.5 H30 Br2 Cl3 N2 P Pd -","- C122 H120 Br8 Cl12 N8 P4 Pd4 -","4","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0806","0.059","","","0.154","0.1685","","","","","","1.091","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078856","9.2378","0.0008","17.1028","0.0015","13.657","0.0012","90","","108.269","0.001","90","","2048.9","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 Br2 Cl2 N3 Pd -","- C17 H19 Br2 Cl2 N3 Pd -","- C68 H76 Br8 Cl8 N12 Pd4 -","4","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0276","0.0225","","","0.0532","0.0548","","","","","","1.025","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078857","10.1973","0.001","15.7552","0.0016","16.6958","0.0017","90","","103.881","0.002","90","","2604","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Br2 Cl2 N4 Pd -","- C23 H26 Br2 Cl2 N4 Pd -","- C92 H104 Br8 Cl8 N16 Pd4 -","4","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0626","0.044","","","0.0964","0.1038","","","","","","1.027","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078858","12.1948","0.0008","14.1073","0.0009","21.3296","0.0014","76.826","0.001","84.054","0.001","79.228","0.001","3502.8","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C133 H182 Br8 Cl6 N12 Pd4 -","- C133 H182 Br8 Cl6 N12 Pd4 -","- C133 H182 Br8 Cl6 N12 Pd4 -","1","0.5","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.0577","0.039","","","0.074","0.0773","","","","","","1.32","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078859","10.359","0.003","12.225","0.003","14.926","0.004","83.575","0.005","81.529","0.005","83.534","0.005","1848.9","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 Br2 N4 Pd -","- C38 H48 Br2 N4 Pd -","- C76 H96 Br4 N8 Pd2 -","2","1","","Bernhammer, Jan C.; Huynh, Han Vinh","Pyrazolin-5-ylidene Palladium(II) Complexes: Synthesis, Characterization, and Application in the Direct Arylation of Pentafluorobenzene","Organometallics","2012","31","14","5121","","10.1021/om300464b","","","0.71073","MoKα","","0.1061","0.0519","","","0.1111","0.1276","","","","","","0.952","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078860","11.98","0.0016","13.501","0.0018","19.619","0.003","90.684","0.002","91.549","0.002","111.316","0.002","2954.2","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H64 Cl2 F12 N10 P2 Ru -","- C55 H64 Cl2 F12 N10 P2 Ru -","- C110 H128 Cl4 F24 N20 P4 Ru2 -","2","1","","Saha, Sayantani; Ghatak, Tapas; Saha, Biswajit; Doucet, Henri; Bera, Jitendra K.","Steric Control at the Wingtip of a Bis-N-Heterocyclic Carbene Ligand: Coordination Behavior and Catalytic Responses of Its Ruthenium Compounds","Organometallics","2012","31","15","5500","","10.1021/om300469n","","","0.71073","MoKα","","0.1132","0.0715","","","0.1495","0.2044","","","","","","1.106","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078861","9.255","0.004","13.765","0.004","15.12","0.005","79.363","0.005","83.911","0.005","75.643","0.003","1830.3","1.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H47 Cl2 F6 N8 P Ru -","- C30 H47 Cl2 F6 N8 P Ru -","- C60 H94 Cl4 F12 N16 P2 Ru2 -","2","1","","Saha, Sayantani; Ghatak, Tapas; Saha, Biswajit; Doucet, Henri; Bera, Jitendra K.","Steric Control at the Wingtip of a Bis-N-Heterocyclic Carbene Ligand: Coordination Behavior and Catalytic Responses of Its Ruthenium Compounds","Organometallics","2012","31","15","5500","","10.1021/om300469n","","","0.71073","MoKα","","0.1107","0.0736","","","0.1705","0.1931","","","","","","1.017","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078862","15.113","0.003","12.812","0.003","16.386","0.003","90","","113.31","0.03","90","","2913.8","1.2","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H43 Cl N2 O Ru -","- C30 H43 Cl N2 O Ru -","- C120 H172 Cl4 N8 O4 Ru4 -","4","1","","Kong, Yong; Xu, Shansheng; Song, Haibin; Wang, Baiquan","Synthesis, Structures, and Norbornene ROMP Behavior ofo-Aryloxide-N-Heterocyclic Carbenep-Cymene Ruthenium Complexes","Organometallics","2012","31","15","5527","","10.1021/om300474n","","","0.71073","MoKα","","0.0285","0.0251","","","0.0641","0.066","","","","","","1.054","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078863","18.4561","0.0009","11.6603","0.0005","26.6072","0.0007","90","","98.614","0.002","90","","5661.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","C56H36Au2O4P2","1,8 dihydroxyanthraquinone dipropargyl ether bis (gold triphenylphosphine)","","- C58 H38 Au2 Cl6 O4 P2 -","- C58 H38 Au2 Cl6 O4 P2 -","- C232 H152 Au8 Cl24 O16 P8 -","4","1","","Balasingham, Rebeca G.; Williams, Catrin F.; Mottram, Huw J.; Coogan, Michael P.; Pope, Simon J. A.","Gold(I) Complexes Derived from Alkynyloxy-Substituted Anthraquinones: Syntheses, Luminescence, Preliminary Cytotoxicity, and Cell Imaging Studies","Organometallics","2012","31","16","5835","","10.1021/om300475y","","","0.71073","MoKα","","0.1848","0.0871","","","0.2013","0.2566","","","","","","1.021","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078864","13.865","0.002","14.152","0.002","15.025","0.003","77.7","0.02","82.64","0.02","84.99","0.03","2851.3","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C65 H72 N2 O2 Si3 -","- C65 H72 N2 O2 Si3 -","- C130 H144 N4 O4 Si6 -","2","1","","Azhakar, Ramachandran; Ghadwal, Rajendra S.; Roesky, Herbert W.; Granitzka, Markus; Stalke, Dietmar","Reactivity Studies of a Stable N-Heterocyclic Silylene with Triphenylsilanol and Pentafluorophenol","Organometallics","2012","31","15","5506","","10.1021/om300476q","","","0.71073","MoKα","","0.0442","0.0352","","","0.0873","0.0928","","","","","","1.026","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078865","12.375","0.002","20.977","0.003","15.757","0.002","90","","103.87","0.02","90","","3971.1","1.1","101","2","101","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H42 F10 N2 O2 Si -","- C41 H42 F10 N2 O2 Si -","- C164 H168 F40 N8 O8 Si4 -","4","1","","Azhakar, Ramachandran; Ghadwal, Rajendra S.; Roesky, Herbert W.; Granitzka, Markus; Stalke, Dietmar","Reactivity Studies of a Stable N-Heterocyclic Silylene with Triphenylsilanol and Pentafluorophenol","Organometallics","2012","31","15","5506","","10.1021/om300476q","","","0.71073","MoKα","","0.04","0.0333","","","0.0863","0.0914","","","","","","1.025","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078866","30.8877","0.0009","12.937","0.0002","18.9561","0.0003","90","","90","","90","","7574.7","0.3","123","2","123","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H40 Li Mg O Si3 -","- C16 H40.3333 Li Mg O Si3 -","- C192 H484 Li12 Mg12 O12 Si36 -","12","3","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.097","0.0845","","","0.1724","0.1763","","","","","","1.147","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078867","9.6476","0.0005","11.0862","0.0006","15.5535","0.0006","104.171","0.004","96.327","0.004","111.437","0.005","1464.12","0.14","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H49 Li Mg O4 Si3 -","- C20 H49 Li Mg O4 Si3 -","- C40 H98 Li2 Mg2 O8 Si6 -","2","1","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.0432","0.034","","","0.091","0.0936","","","","","","1.079","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078868","12.6467","0.0007","12.7597","0.0007","15.1259","0.0008","80.209","0.004","69.849","0.005","79.137","0.004","2235.7","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H37 Li Mg O Si3 -","- C14 H37 Li Mg O Si3 -","- C56 H148 Li4 Mg4 O4 Si12 -","4","2","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.0869","0.0355","","","0.0581","0.0643","","","","","","0.688","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078869","11.1275","0.0007","11.1275","0.0007","36.035","0.005","90","","90","","90","","4461.9","0.7","150","2","150","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C28 H76 Li2 Mg N4 Si4 -","- C28 H76 Li2 Mg N4 Si4 -","- C112 H304 Li8 Mg4 N16 Si16 -","4","0.5","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.1544","0.0478","","","0.0883","0.0991","","","","","","0.695","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078870","9.8686","0.0003","16.9877","0.0007","19.5686","0.0008","90","","97.643","0.003","90","","3251.4","0.2","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H56 Li Mg N3 Si3 -","- C21 H56 Li Mg N3 Si3 -","- C84 H224 Li4 Mg4 N12 Si12 -","4","1","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.0882","0.0469","","","0.1082","0.1178","","","","","","0.937","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078871","14.1664","0.0005","30.7009","0.0009","21.7025","0.0007","90","","95.679","0.003","90","","9392.6","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H156 Li2 Mg4 N6 O Si10 -","- C58 H156 Li2 Mg4 N6 O Si10 -","- C232 H624 Li8 Mg16 N24 O4 Si40 -","4","1","","Baillie, Sharon E.; Clegg, William; Garc\?ía-Álvarez, Pablo; Hevia, Eva; Kennedy, Alan R.; Klett, Jan; Russo, Luca","Synthesis, Structural Elucidation, and Diffusion-Ordered NMR Studies of Homoleptic Alkyllithium Magnesiates: Donor-Controlled Structural Variations in Mixed-Metal Chemistry","Organometallics","2012","31","14","5131","","10.1021/om300477m","","","0.71073","MoKα","","0.0864","0.0386","","","0.0796","0.0861","","","","","","0.853","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078872","11.4874","0.0005","14.5877","0.0006","20.6198","0.001","110.077","0.002","93.425","0.002","107.986","0.002","3033.2","0.2","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C70 H55 Al N4 O2 Si2 -","- C70 H55 Al N4 O2 Si2 -","- C140 H110 Al2 N8 O4 Si4 -","2","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Meerwein‒Ponndorf‒Verley-Type Reduction Processes in Aluminum and Indium Isopropoxide Complexes of Imino-Phenolate Ligands","Organometallics","2012","31","15","5511","","10.1021/om300481q","","x-ray","0.71073","MoKα","","0.0704","0.0508","","","0.1392","0.1497","","","","","","1.063","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078873","17.1495","0.0005","11.1441","0.0003","18.2625","0.0005","90","","115.337","0.001","90","","3154.51","0.15","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H33 In N2 O Si -","- C37 H33 In N2 O Si -","- C148 H132 In4 N8 O4 Si4 -","4","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Meerwein‒Ponndorf‒Verley-Type Reduction Processes in Aluminum and Indium Isopropoxide Complexes of Imino-Phenolate Ligands","Organometallics","2012","31","15","5511","","10.1021/om300481q","","x-ray","0.71073","MoKα","","0.0365","0.0281","","","0.0689","0.074","","","","","","1.048","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078874","14.5921","0.0004","15.1638","0.0004","19.8274","0.0006","90","","99.837","0.001","90","","4322.7","0.2","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H52 In N2 O Si3 -","- C46 H52 In N2 O Si3 -","- C184 H208 In4 N8 O4 Si12 -","4","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Meerwein‒Ponndorf‒Verley-Type Reduction Processes in Aluminum and Indium Isopropoxide Complexes of Imino-Phenolate Ligands","Organometallics","2012","31","15","5511","","10.1021/om300481q","","x-ray","0.71073","MoKα","","0.0327","0.0251","","","0.0779","0.0953","","","","","","1.186","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078875","16.5875","0.0006","18.1081","0.0006","40.2373","0.0016","90","","90","","90","","12086","0.8","150","2","150","2","","","","","","","synthesis as described","6","P c a b","-P 2bc 2ac","61","","","","- C74 H65 In N4 O3 Si2 -","- C74 H65 In N4 O3 Si2 -","- C592 H520 In8 N32 O24 Si16 -","8","1","","Normand, Mickael; Kirillov, Evgeny; Roisnel, Thierry; Carpentier, Jean-François","Meerwein‒Ponndorf‒Verley-Type Reduction Processes in Aluminum and Indium Isopropoxide Complexes of Imino-Phenolate Ligands","Organometallics","2012","31","15","5511","","10.1021/om300481q","","x-ray","0.71073","MoKα","","0.0729","0.0533","","","0.0991","0.1056","","","","","","1.146","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078876","8.581","0.0016","15.042","0.003","10.0622","0.0019","90","","91.788","0.003","90","","1298.2","0.4","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cl6 N2 Ti2 -","- C16 H36 Cl6 N2 Ti2 -","- C32 H72 Cl12 N4 Ti4 -","2","0.5","","Spicer, Charles W.; Lovitt, Charity Flener; Girolami, Gregory S.","Nonagostic M···H‒C Interactions. Synthesis, Characterization, and DFT Study of the Titanium Amide Ti2Cl6[N(t-Bu)2]2","Organometallics","2012","31","13","4894","","10.1021/om300483v","","","0.71073","MoKα","","0.0335","0.0259","","","0.0617","0.0639","","","","","","1.003","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078877","7.512","0.002","20.436","0.007","8.291","0.003","90","","90.484","0.005","90","","1272.7","0.7","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H36 Cl6 N2 Ti2 -","- C16 H36 Cl6 N2 Ti2 -","- C32 H72 Cl12 N4 Ti4 -","2","0.5","","Spicer, Charles W.; Lovitt, Charity Flener; Girolami, Gregory S.","Nonagostic M···H‒C Interactions. Synthesis, Characterization, and DFT Study of the Titanium Amide Ti2Cl6[N(t-Bu)2]2","Organometallics","2012","31","13","4894","","10.1021/om300483v","","","0.71073","MoKα","","0.0549","0.0418","","","0.1151","0.1215","","","","","","1.115","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078878","12.728","0.003","15.881","0.003","18.128","0.003","73.738","0.004","88.468","0.005","87.523","0.005","3514","1.2","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C79 H52 B F24 P2 Ru -","- C79 H52 B F24 P2 Ru -","- C158 H104 B2 F48 P4 Ru2 -","2","1","","Mutoh, Yuichiro; Kimura, Yusuke; Ikeda, Yousuke; Tsuchida, Noriko; Takano, Keiko; Ishii, Youichi","Formation of (Alkenylphosphonio)phenylruthenium Complexes from Diphenylacetylene and a [CpRu(dppm)] Cation: Experimental Evidence for the Equilibrium between η1-Disubstituted Vinylidene and η2-Internal Alkyne","Organometallics","2012","31","14","5150","","10.1021/om3004948","","","0.71075","MoKα","","","0.0739","","","","0.178","","","","","","1.071","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078879","10.7153","0.0016","18.425","0.003","19.554","0.003","82.693","0.004","87.357","0.004","75.42","0.004","3705.5","1","123","","123","","","","","","","","","6","P -1","-P 1","2","","","","- C82 H63 B F24 P2 Ru -","- C82 H63 B F24.0001 P2 Ru -","- C164 H126 B2 F48.0002 P4 Ru2 -","2","1","","Mutoh, Yuichiro; Kimura, Yusuke; Ikeda, Yousuke; Tsuchida, Noriko; Takano, Keiko; Ishii, Youichi","Formation of (Alkenylphosphonio)phenylruthenium Complexes from Diphenylacetylene and a [CpRu(dppm)] Cation: Experimental Evidence for the Equilibrium between η1-Disubstituted Vinylidene and η2-Internal Alkyne","Organometallics","2012","31","14","5150","","10.1021/om3004948","","","0.7107","MoKα","","","0.0508","","","","0.139","","","","","","0.984","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078880","16.69","0.002","18.527","0.002","24.597","0.003","69.419","0.004","84.293","0.005","78.708","0.005","6978.6","1.4","113","","113","","","","","","","","","6","P -1","-P 1","2","","","","- C76 H49 B F24 P2 Ru -","- C76 H49 B F24 P2 Ru -","- C304 H196 B4 F96 P8 Ru4 -","4","2","","Mutoh, Yuichiro; Kimura, Yusuke; Ikeda, Yousuke; Tsuchida, Noriko; Takano, Keiko; Ishii, Youichi","Formation of (Alkenylphosphonio)phenylruthenium Complexes from Diphenylacetylene and a [CpRu(dppm)] Cation: Experimental Evidence for the Equilibrium between η1-Disubstituted Vinylidene and η2-Internal Alkyne","Organometallics","2012","31","14","5150","","10.1021/om3004948","","","0.71075","MoKα","","","0.0598","","","","0.1594","","","","","","1.09","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078881","11.792","0.004","18.592","0.005","31.093","0.009","90","","94.878","0.003","90","","6792","4","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H49 B F24 P2 Ru -","- C76 H49 B F24 P2 Ru -","- C304 H196 B4 F96 P8 Ru4 -","4","1","","Mutoh, Yuichiro; Kimura, Yusuke; Ikeda, Yousuke; Tsuchida, Noriko; Takano, Keiko; Ishii, Youichi","Formation of (Alkenylphosphonio)phenylruthenium Complexes from Diphenylacetylene and a [CpRu(dppm)] Cation: Experimental Evidence for the Equilibrium between η1-Disubstituted Vinylidene and η2-Internal Alkyne","Organometallics","2012","31","14","5150","","10.1021/om3004948","","","0.71075","MoKα","","","0.049","","","","0.1126","","","","","","1.086","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078882","9.58","0.0019","10.61","0.002","19.53","0.004","90","","93.14","0.03","90","","1982.1","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Au Cl2 N3 -","- C22 H16 Au Cl2 N3 -","- C88 H64 Au4 Cl8 N12 -","4","1","","Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Montanel-Pérez, Sara; Villacampa, M. Dolores","Facile Synthesis of Gold(III) Aryl‒Carbene Metallacycles","Organometallics","2012","31","15","5520","","10.1021/om300495u","","","0.71073","MoKα","","0.0272","0.0205","","","0.0444","0.0466","","","","","","1.045","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078883","11.02","0.002","13.068","0.003","13.431","0.003","103.22","0.03","96.52","0.03","103.86","0.03","1798.9","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H20 Au Cl2 N3 -","- C18 H20 Au Cl2 N3 -","- C72 H80 Au4 Cl8 N12 -","4","2","","Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Montanel-Pérez, Sara; Villacampa, M. Dolores","Facile Synthesis of Gold(III) Aryl‒Carbene Metallacycles","Organometallics","2012","31","15","5520","","10.1021/om300495u","","","0.71073","MoKα","","0.0544","0.0388","","","0.0904","0.0985","","","","","","1.026","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078884","9.3","0.0019","10.27","0.002","20.1","0.004","90","","100.55","0.03","90","","1887.3","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Au Cl2 N3 -","- C18 H20 Au Cl2 N3 -","- C72 H80 Au4 Cl8 N12 -","4","1","","Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Montanel-Pérez, Sara; Villacampa, M. Dolores","Facile Synthesis of Gold(III) Aryl‒Carbene Metallacycles","Organometallics","2012","31","15","5520","","10.1021/om300495u","","","0.71073","MoKα","","0.0415","0.0394","","","0.0979","0.0991","","","","","","1.065","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078885","8.93","0.0018","15.12","0.003","14.03","0.003","90","","101.92","0.03","90","","1853.5","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Au Cl2 N3 -","- C20 H18 Au Cl2 N3 -","- C80 H72 Au4 Cl8 N12 -","4","1","","Crespo, Olga; Gimeno, M. Concepción; Laguna, Antonio; Montanel-Pérez, Sara; Villacampa, M. Dolores","Facile Synthesis of Gold(III) Aryl‒Carbene Metallacycles","Organometallics","2012","31","15","5520","","10.1021/om300495u","","","0.71073","MoKα","","0.0355","0.0299","","","0.0759","0.0791","","","","","","1.078","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078886","11.2294","0.0007","15.0839","0.001","14.5169","0.0009","90","","107.908","0.001","90","","2339.8","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 B N6 Ru S2 -","- C21 H29 B N6 Ru S2 -","- C84 H116 B4 N24 Ru4 S8 -","4","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich (Cp*/(HMB))Ru Complexes Containing Bis(methimazolyl)(pyrazolyl)borate (Cp* = η5-C5Me5, HMB = η6-C6Me6)","Organometallics","2012","31","14","5159","","10.1021/om300497p","","","0.71073","MoKα","","0.0651","0.0578","","","0.158","0.1643","","","","","","1.047","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078887","12.9471","0.0013","12.1262","0.0013","21.102","0.002","90","","93.458","0.003","90","","3307","0.6","223","2","223","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C23.5 H32.25 B F6 N6.75 P Ru S2 -","- C23.5 H33.25 B F6 N6.25 P Ru S2 -","- C94 H133 B4 F24 N25 P4 Ru4 S8 -","4","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich (Cp*/(HMB))Ru Complexes Containing Bis(methimazolyl)(pyrazolyl)borate (Cp* = η5-C5Me5, HMB = η6-C6Me6)","Organometallics","2012","31","14","5159","","10.1021/om300497p","","","0.71073","MoKα","","0.1798","0.1632","","","0.3434","0.3515","","","","","","1.257","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078888","13.0005","0.0007","17.764","0.0008","13.2947","0.0006","90","","110.615","0.001","90","","2873.7","0.2","243","2","243","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 B Cl3 N6 Ru S2 -","- C24 H34 B Cl3 N6 Ru S2 -","- C96 H136 B4 Cl12 N24 Ru4 S8 -","4","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich (Cp*/(HMB))Ru Complexes Containing Bis(methimazolyl)(pyrazolyl)borate (Cp* = η5-C5Me5, HMB = η6-C6Me6)","Organometallics","2012","31","14","5159","","10.1021/om300497p","","","0.71073","MoKα","","0.0843","0.0702","","","0.1768","0.1861","","","","","","1.091","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078889","18.3084","0.0007","12.002","0.0004","15.6542","0.0006","90","","123.198","0.001","90","","2878.38","0.19","243","2","243","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C25 H37 B N6 O3 Ru S2 -","- C25 H37 B N6 O3.01 Ru S2 -","- C100 H148 B4 N24 O12.04 Ru4 S8 -","4","0.5","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich (Cp*/(HMB))Ru Complexes Containing Bis(methimazolyl)(pyrazolyl)borate (Cp* = η5-C5Me5, HMB = η6-C6Me6)","Organometallics","2012","31","14","5159","","10.1021/om300497p","","","0.71073","MoKα","","0.0474","0.0439","","","0.1054","0.1079","","","","","","1.173","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078890","40.061","0.002","13.1846","0.0008","9.6673","0.0006","90","","92.534","0.001","90","","5101.2","0.5","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H29 B N6 O Ru S2 -","- C22 H29 B N6 O Ru S2 -","- C176 H232 B8 N48 O8 Ru8 S16 -","8","1","","Kuan, Seah Ling; Leong, Weng Kee; Webster, Richard D.; Goh, Lai Yoong","Mixed-Sandwich (Cp*/(HMB))Ru Complexes Containing Bis(methimazolyl)(pyrazolyl)borate (Cp* = η5-C5Me5, HMB = η6-C6Me6)","Organometallics","2012","31","14","5159","","10.1021/om300497p","","","0.71073","MoKα","","0.074","0.0617","","","0.1329","0.1414","","","","","","1.147","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078891","9.7112","0.0016","9.9467","0.0014","13.852","0.002","70.142","0.008","77.515","0.009","75.018","0.008","1203.5","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H36 Zn3 -","- C24 H36 Zn3 -","- C48 H72 Zn6 -","2","1","","Zhou, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng","1,3-Butadienylzinc Trimer Formed via Transmetalation from 1,4-Dilithio-1,3-butadienes: Synthesis, Structural Characterization, and Application in Negishi Cross-Coupling","Organometallics","2012","31","15","5546","","10.1021/om3005004","","","0.71073","MoKα","","0.0382","0.0356","","","0.085","0.0868","","","","","","1.112","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078892","11.557","0.004","11.557","0.004","48.53","0.019","90","","90","","120","","5613","4","173","2","173","2","","","","","","","","3","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C36 H60 Zn3 -","- C36 H60 Zn3 -","- C216 H360 Zn18 -","6","0.5","","Zhou, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng","1,3-Butadienylzinc Trimer Formed via Transmetalation from 1,4-Dilithio-1,3-butadienes: Synthesis, Structural Characterization, and Application in Negishi Cross-Coupling","Organometallics","2012","31","15","5546","","10.1021/om3005004","","","0.71073","MoKα","","0.05","0.0461","","","0.0951","0.0983","","","","","","1.126","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078893","20.106","0.004","13.786","0.003","38.576","0.008","90","","95.04","0.03","90","","10651","4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C39 H79 Si6 Zn3 -","- C39 H72 Si6 Zn3 -","- C312 H576 Si48 Zn24 -","8","1","","Zhou, Yi; Zhang, Wen-Xiong; Xi, Zhenfeng","1,3-Butadienylzinc Trimer Formed via Transmetalation from 1,4-Dilithio-1,3-butadienes: Synthesis, Structural Characterization, and Application in Negishi Cross-Coupling","Organometallics","2012","31","15","5546","","10.1021/om3005004","","","0.71073","MoKα","","0.2297","0.0415","","","0.0612","0.0787","","","","","","0.586","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078894","9.8205","0.0002","16.7399","0.0004","14.5673","0.0004","90","","106.695","0.002","90","","2293.83","0.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H30 Co4 Si -","- C25 H30 Co4 Si -","- C100 H120 Co16 Si4 -","4","1","","Weding, Nico; Spannenberg, Anke; Jackstell, Ralf; Hapke, Marko","Formation and Reactivity of a Co4-μ-Alkyne Cluster from a Co(I)-Alkene Complex","Organometallics","2012","31","15","5660","","10.1021/om300503y","","","0.71073","MoKα","","0.035","0.025","","","0.0563","0.0581","","","","","","0.95","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078895","16.7463","0.0004","16.0456","0.0004","25.7734","0.0007","90","","95.0336","0.0013","90","","6898.7","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H102 B N8 O2 Zr2 -","- C62.012 H102.03 B N8 O2 Zr2 -","- C248.048 H408.12 B4 N32 O8 Zr8 -","4","0.5","","Munhá, Rui F.; Ballmann, Joachim; Veiros, Luis F.; Patrick, Brian O.; Fryzuk, Michael D.; Martins, Ana M.","Dinuclear Cationic Zirconium Hydrides Stabilized by theN,N-Dibenzylcyclam Ancillary Ligand","Organometallics","2012","31","14","4937","","10.1021/om300504q","","","0.71073","MoKα","","0.0783","0.0547","","","0.1645","0.1793","","","","","","1.125","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4078896","10.495","0.0002","22.473","0.0004","10.692","0.0002","90","","106.091","0.0007","90","","2422.96","0.08","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H32 Al Br O S -","- C23 H32 Al Br O S -","- C92 H128 Al4 Br4 O4 S4 -","4","1","","Lamberti, Marina; D’Auria, Ilaria; Mazzeo, Mina; Milione, Stefano; Bertolasi, Valerio; Pappalardo, Daniela","Phenoxy-Thioether Aluminum Complexes as ε-Caprolactone and Lactide Polymerization Catalysts","Organometallics","2012","31","15","5551","","10.1021/om300505m","","","0.71073","MoKα","","0.0778","0.0491","","","0.112","0.1225","","","","","","1.032","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078897","13.3202","0.0009","20.7887","0.0014","12.1869","0.0008","90","","92.069","0.001","90","","3372.5","0.4","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C37 H34 B Cl2 F4 Ir N4 O2 -","- C37 H34 B Cl2 F4 Ir N4 O2 -","- C148 H136 B4 Cl8 F16 Ir4 N16 O8 -","4","1","","Rahaman, S. M. Wahidur; Dinda, Shrabani; Ghatak, Tapas; Bera, Jitendra K.","Carbon Monoxide Induced Double Cyclometalation at the Iridium Center","Organometallics","2012","31","15","5533","","10.1021/om300506v","","","0.71073","MoKα","","0.0478","0.0387","","","0.089","0.0931","","","","","","0.995","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078898","18.571","0.0016","20.5555","0.0019","9.1403","0.0008","90","","107.124","0.001","90","","3334.5","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C38 H24 B F4 Ir N4 O2 -","- C38 H24 B F4 Ir N4 O2 -","- C152 H96 B4 F16 Ir4 N16 O8 -","4","0.5","","Rahaman, S. M. Wahidur; Dinda, Shrabani; Ghatak, Tapas; Bera, Jitendra K.","Carbon Monoxide Induced Double Cyclometalation at the Iridium Center","Organometallics","2012","31","15","5533","","10.1021/om300506v","","","0.71073","MoKα","","0.0433","0.0383","","","0.0936","0.0963","","","","","","1.02","","","","has coordinates,has disorder","178677","2020-10-21","18:00:00",""
"4078899","13.0649","0.0008","13.8904","0.0008","24.7436","0.0015","90","","102.165","0.001","90","","4389.6","0.5","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C44 H30 B Cl2 F4 Ir N6 O -","- C44 H30 B Cl2 F4 Ir N6 O -","- C176 H120 B4 Cl8 F16 Ir4 N24 O4 -","4","1","","Rahaman, S. M. Wahidur; Dinda, Shrabani; Ghatak, Tapas; Bera, Jitendra K.","Carbon Monoxide Induced Double Cyclometalation at the Iridium Center","Organometallics","2012","31","15","5533","","10.1021/om300506v","","","0.71073","MoKα","","0.0669","0.0442","","","0.0886","0.1049","","","","","","1.059","","","","has coordinates","178677","2020-10-21","18:00:00",""
"4078900","11.2041","0.0011","22.758","0.002","21.031","0.002","90","","92.144","0.002","90","","5358.8","0.9","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C64 H72 Li8 O9 -","- C64 H72 Li8 O9 -","- C256 H288 Li32 O36 -","4","1","","Zabula, Alexander V.; Spisak, Sarah N.; Filatov, Alexander S.; Petrukhina, Marina A.","Self-Assembly of Charged Supramolecular Sandwiches Formed by Corannulene Tetraanions and Lithium Cations","Organometallics","2012","31","15","5541","","10.1021/om300507z","","","0.71073","Mo-Kα","","0.0946","0.0572","","","0.0911","0.1041","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078901","8.1564","0.0004","13.2101","0.0006","14.2977","0.0007","108.985","0.004","102.089","0.004","98.667","0.004","1383.96","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H29 I3 Ir N5 -","- C20 H29 I3 Ir N5 -","- C40 H58 I6 Ir2 N10 -","2","1","","Segarra, Candela; Mas-Marzá, Elena; Mata, José A.; Peris, Eduardo","Rhodium and Iridium Complexes with ChelatingC‒C′-Imidazolylidene‒Pyridylidene Ligands: Systematic Approach to Normal, Abnormal, and Remote Coordination Modes","Organometallics","2012","31","14","5169","","10.1021/om3005096","","","0.71073","MoKα","","0.045","0.0322","","","0.0689","0.0769","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078902","7.3202","0.0006","11.6155","0.0013","27.281","0.002","90","","90","","90","","2319.6","0.4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H20 I3 N5 O2 Rh -","- C14 H21 I3 N5 O2 Rh -","- C56 H84 I12 N20 O8 Rh4 -","4","0.5","","Segarra, Candela; Mas-Marzá, Elena; Mata, José A.; Peris, Eduardo","Rhodium and Iridium Complexes with ChelatingC‒C′-Imidazolylidene‒Pyridylidene Ligands: Systematic Approach to Normal, Abnormal, and Remote Coordination Modes","Organometallics","2012","31","14","5169","","10.1021/om3005096","","","0.71073","MOKα","","0.063","0.0432","","","0.0839","0.0931","","","","","","1.212","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078903","11.3673","0.0004","24.5851","0.0007","7.6286","0.0003","90","","100.612","0.003","90","","2095.47","0.13","199.95","0.1","199.95","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 I3 N5 Rh -","- C14 H17 I3 N5 Rh -","- C56 H68 I12 N20 Rh4 -","4","1","","Segarra, Candela; Mas-Marzá, Elena; Mata, José A.; Peris, Eduardo","Rhodium and Iridium Complexes with ChelatingC‒C′-Imidazolylidene‒Pyridylidene Ligands: Systematic Approach to Normal, Abnormal, and Remote Coordination Modes","Organometallics","2012","31","14","5169","","10.1021/om3005096","","","0.7107","MoKα","","0.0636","0.0417","","","0.0945","0.1056","","","","","","1.057","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078904","10.181","0.0006","11.0855","0.0005","12.6852","0.0007","107.112","0.004","94.167","0.004","112.461","0.005","1236.42","0.13","220","0.1","220","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C17 H22 I3 Ir N6 -","- C17 H22 I3 Ir N6 -","- C34 H44 I6 Ir2 N12 -","2","1","","Segarra, Candela; Mas-Marzá, Elena; Mata, José A.; Peris, Eduardo","Rhodium and Iridium Complexes with ChelatingC‒C′-Imidazolylidene‒Pyridylidene Ligands: Systematic Approach to Normal, Abnormal, and Remote Coordination Modes","Organometallics","2012","31","14","5169","","10.1021/om3005096","","","0.7107","MoKα","","0.0853","0.0462","","","0.1021","0.1253","","","","","","1.03","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078905","12.1324","0.0012","12.8187","0.0015","12.7936","0.0015","90","","97.575","0.003","90","","1972.3","0.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H27 Nb O Si2 -","- C17 H27 Nb O Si2 -","- C68 H108 Nb4 O4 Si8 -","4","1","","Antiñolo, Antonio; Dorani, Khédidja; García-Yuste, Santiago; López-Solera, Isabel; Otero, Antonio; Tercero-Morales, María Teresa; Kovács, Gábor; Ujaque, Gregori; Lledós, Agustí","Experimental and Theoretical Studies of the Hydrogenation of α,β-Unsaturated Acids by an 18eHydride Carbonylniobocene Complex","Organometallics","2012","31","14","5177","","10.1021/om300510m","","","0.71073","MoKα","","0.0483","0.0365","","","0.0871","0.0916","","","","","","0.961","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078906","10.9419","0.0014","12.9169","0.0017","21.3","0.003","84.167","0.002","76.817","0.002","80.056","0.002","2881","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H67 N3 O P2 Ru -","- C68 H67 N3 O P2 Ru -","- C136 H134 N6 O2 P4 Ru2 -","2","1","","Liu, Pei Nian; Li, Juan; Su, Fu Hai; Ju, Kun Dong; Zhang, Li; Shi, Chuan; Sung, Herman H. Y.; Williams, Ian D.; Fokin, Valery V.; Lin, Zhenyang; Jia, Guochen","Selective Formation of 1,4-Disubstituted Triazoles from Ruthenium-Catalyzed Cycloaddition of Terminal Alkynes and Organic Azides: Scope and Reaction Mechanism","Organometallics","2012","31","13","4904","","10.1021/om300513w","","","0.71073","MoKα","","0.0536","0.0358","","","0.0716","0.0757","","","","","","0.993","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078907","5.9355","0.0005","11.14","0.001","11.9239","0.0011","81.134","0.008","78.547","0.008","87.266","0.007","763.37","0.12","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 N3 O2 S -","- C16 H15 N3 O2 S -","- C32 H30 N6 O4 S2 -","2","1","","Liu, Pei Nian; Li, Juan; Su, Fu Hai; Ju, Kun Dong; Zhang, Li; Shi, Chuan; Sung, Herman H. Y.; Williams, Ian D.; Fokin, Valery V.; Lin, Zhenyang; Jia, Guochen","Selective Formation of 1,4-Disubstituted Triazoles from Ruthenium-Catalyzed Cycloaddition of Terminal Alkynes and Organic Azides: Scope and Reaction Mechanism","Organometallics","2012","31","13","4904","","10.1021/om300513w","","","1.54178","CuKα","","0.049","0.0422","","","0.1132","0.1174","","","","","","1.023","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078908","10.5386","0.0011","11.7472","0.0012","12.8934","0.0014","90","","90","","90","","1596.2","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H18 B10 F3 N3 O2 -","- C6 H18 B10 F3 N3 O2 -","- C24 H72 B40 F12 N12 O8 -","4","1","","El-Zaria, Mohamed E.; Janzen, Nancy; Valliant, John F.","Room-Temperature Synthesis of Re(I) and Tc(I) Metallocarboranes","Organometallics","2012","31","16","5940","","10.1021/om300521j","","","0.71073","MoKα","","0.053","0.043","","","0.0965","0.1023","","","","","","1.038","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078909","6.792","0.0008","17.2469","0.0019","10.1981","0.0012","90","","108.321","0.002","90","","1134.1","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H18 B9 N3 -","- C4 H18 B9 N3 -","- C16 H72 B36 N12 -","4","1","","El-Zaria, Mohamed E.; Janzen, Nancy; Valliant, John F.","Room-Temperature Synthesis of Re(I) and Tc(I) Metallocarboranes","Organometallics","2012","31","16","5940","","10.1021/om300521j","","","0.71073","MoKα","","0.0668","0.0495","","","0.1109","0.1217","","","","","","1.073","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078910","10.168","0.004","12.973","0.004","10.443","0.004","90","","100.306","0.006","90","","1355.3","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H16 B10 N4 O2 -","- C4.006 H16.033 B10.03 N4 O2 -","- C16.024 H64.132 B40.12 N16 O8 -","4","1","","El-Zaria, Mohamed E.; Janzen, Nancy; Valliant, John F.","Room-Temperature Synthesis of Re(I) and Tc(I) Metallocarboranes","Organometallics","2012","31","16","5940","","10.1021/om300521j","","","0.71073","MoKα","","0.167","0.118","","","0.2854","0.3209","","","","","","1.032","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078911","12.0868","0.0008","13.6079","0.0009","10.8596","0.0007","90","","97.94","0.003","90","","1769","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H22 B10 F3 N3 O2 -","- C8 H22 B10 F3 N3 O2 -","- C32 H88 B40 F12 N12 O8 -","4","1","","El-Zaria, Mohamed E.; Janzen, Nancy; Valliant, John F.","Room-Temperature Synthesis of Re(I) and Tc(I) Metallocarboranes","Organometallics","2012","31","16","5940","","10.1021/om300521j","","","1.54178","CuKα","","0.0918","0.0818","","","0.2486","0.2565","","","","","","1.527","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078912","7.0444","0.0002","13.8224","0.0003","14.3463","0.0003","90","","103.927","0.001","90","","1355.84","0.06","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H22 B9 N3 -","- C6 H22 B9 N3 -","- C24 H88 B36 N12 -","4","1","","El-Zaria, Mohamed E.; Janzen, Nancy; Valliant, John F.","Room-Temperature Synthesis of Re(I) and Tc(I) Metallocarboranes","Organometallics","2012","31","16","5940","","10.1021/om300521j","","","1.54178","CuKα","","0.0463","0.0437","","","0.1272","0.131","","","","","","1.047","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078913","12.9954","0.0001","22.885","0.0002","20.2845","0.0002","90","","93.038","0.0006","90","","6024.13","0.09","200","","200","","","","","","","","local","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H50 F8 P4 Pd2 -","- C72 H50 F8 P4 Pd2 -","- C288 H200 F32 P16 Pd8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0509","0.0256","","0.0754","0.0572","0.0754","","","","","","0.9632","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078914","13.1071","0.0002","23.2833","0.0002","20.0903","0.0003","90","","93.2236","0.0006","90","","6121.39","0.14","200","","200","","","","","","","","from RMIT University","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H50 As2 F8 P2 Pd2 -","- C72 H50 As2 F8 P2 Pd2 -","- C288 H200 As8 F32 P8 Pd8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0738","0.0415","","0.0757","0.0696","0.0757","","","","","","0.9572","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078915","19.7128","0.0003","21.4914","0.0003","13.9542","0.0002","90","","90","","90","","5911.78","0.15","200","","200","","","","","","","","from RMITU","6","P b c n","-P 2n 2ab","60","","","","- C64 H56 F8 N2 P2 Pd2 -","- C64 H56 F8 N2 P2 Pd2 -","- C256 H224 F32 N8 P8 Pd8 -","4","0.5","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0538","0.0267","","0.1278","0.0869","0.1278","","","","","","0.9409","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078916","12.2048","0.0002","12.2048","0.0002","30.1528","0.0004","90","","90","","90","","4491.47","0.12","200","","200","","","","","","","","from RMITU","6","P 41 21 2","P 4abw 2nw","92","","","","- C46 H38 F8 N2 P2 Pd2 -","- C46 H38 F8 N2 P2 Pd2 -","- C184 H152 F32 N8 P8 Pd8 -","4","0.5","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0268","0.0204","","0.0537","0.0491","0.0537","","","","","","0.9069","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078917","12.9761","0.0001","22.8436","0.0002","20.3033","0.0001","90","","92.9339","0.0004","90","","6010.43","0.08","200","","200","","","","","","","","from RMITU","5","P 1 21/n 1","-P 2yn","14","","","","- C72 H50 F8 P4 Pt2 -","- C72 H50 F8 P4 Pt2 -","- C288 H200 F32 P16 Pt8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0317","0.0225","","0.0618","0.0507","0.0618","","","","","","0.7736","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078918","15.1933","0.0007","16.7722","0.0008","17.8033","0.0008","90","","109.532","0.001","90","","4275.7","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H38 F8 N2 P2 Pt2 -","- C46 H38 F8 N2 P2 Pt2 -","- C184 H152 F32 N8 P8 Pt8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0692","0.0376","","","0.06","0.0655","","","","","","0.973","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078919","12.801","0.0002","14.8766","0.0003","20.1361","0.0004","106.509","0.001","93.0296","0.0012","105.503","0.001","3508.17","0.12","200","","200","","","","","","","","from RMITU","7","P -1","-P 1","2","","","","- C74 H54 Cl4 F14 I P5 Pt2 -","- C74 H54 Cl4 F14 I P5 Pt2 -","- C148 H108 Cl8 F28 I2 P10 Pt4 -","2","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.074","0.0583","","0.1118","0.1047","0.1118","","","","","","0.9763","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078920","11.3916","0.0002","21.724","0.0004","44.4879","0.0008","90","","90","","90","","11009.5","0.3","200","","200","","","","","","","","from RMIT University","6","P 21 21 21","P 2ac 2ab","19","","","","- C119 H88 F16 I4 P6 Pd4 -","- C119 H88 F16 I4 P6 Pd4 -","- C476 H352 F64 I16 P24 Pd16 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0405","0.0292","","0.0937","0.0759","0.0937","","","","","","0.7691","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078921","17.0645","0.0006","16.4054","0.0006","16.9043","0.0006","90","","90","","90","","4732.4","0.3","150","2","150","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C54 H35 Cl2 F8 P3 Pd2 -","- C54 H35 Cl2 F8 P3 Pd2 -","- C216 H140 Cl8 F32 P12 Pd8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0426","0.0306","","","0.0635","0.0668","","","","","","1.017","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4078922","18.0043","0.0004","17.8269","0.0005","18.876","0.0005","90","","94.7219","0.0017","90","","6037.9","0.3","200","","200","","","","","","","","from RMIT University","6","P 1 21/a 1","-P 2yab","14","","","","- C61 H44 F8 I P3 Pd2 -","- C61 H44 F8 I P3 Pd2 -","- C244 H176 F32 I4 P12 Pd8 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0976","0.0438","","0.1118","0.0971","0.1118","","","","","","0.8295","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078923","11.3738","0.0001","32.8254","0.0003","12.0304","0.0001","90","","98.3916","0.0005","90","","4443.46","0.07","200","","200","","","","","","","","from RMITU","5","P 1 21/a 1","-P 2yab","14","","","","- C54 H35 F8 P3 Pd -","- C54 H35 F8 P3 Pd -","- C216 H140 F32 P12 Pd4 -","4","1","","Bhargava, Suresh K.; Privér, Steven H.; Willis, Anthony C.; Bennett, Martin A.","Preparation, Structure, and Reactivity of Dipalladium(I) Complexes Containing the Carbanion 2-C6F4PPh2: Coexistence of Distinct, Noninterconverting Head-to-Head [Dipalladium(0/II)] and Head-to-Tail [Dipalladium(I)] Species","Organometallics","2012","31","15","5561","","10.1021/om300525p","","","0.71073","MoKα","","0.0469","0.0314","","0.0685","0.0641","0.0685","","","","","","0.9697","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078924","8.9496","0.0002","16.0002","0.0003","18.8016","0.0004","90","","90.837","0.001","90","","2692.02","0.1","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H41 Br Si5 -","- C20 H41 Br Si5 -","- C80 H164 Br4 Si20 -","4","1","","Cho, Hyeon Mo; Bok, Kyongjin; Park, Seo Hyeon; Lim, Young Mook; Lee, Myong Euy; Choi, Moon-Gun; Lee, Kang Mun","A New Synthetic Route for Silacyclopropanes: Reactions of a Bromosilylenoid with Olefins","Organometallics","2012","31","15","5227","","10.1021/om3005349","","","1.54178","CuKα","","0.0629","0.0379","","","0.0796","0.0895","","","","","","1.066","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078925","13.2528","0.0017","12.3497","0.0014","31.634","0.004","90","","90","","90","","5177.5","1.1","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H39 Br O Si4 -","- C19 H39 Br O Si4 -","- C152 H312 Br8 O8 Si32 -","8","1","","Cho, Hyeon Mo; Bok, Kyongjin; Park, Seo Hyeon; Lim, Young Mook; Lee, Myong Euy; Choi, Moon-Gun; Lee, Kang Mun","A New Synthetic Route for Silacyclopropanes: Reactions of a Bromosilylenoid with Olefins","Organometallics","2012","31","15","5227","","10.1021/om3005349","","","0.71073","MoKα","","0.1038","0.049","","","0.1299","0.1863","","","","","","1.001","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078926","9.2548","0.0007","24.9766","0.0018","14.0908","0.001","90","","91.183","0.001","90","","3256.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H56 B2 P2 -","- C31 H56 B2 P2 -","- C124 H224 B8 P8 -","4","1","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","0.71073","MoKα","","0.0717","0.0545","","","0.1405","0.1542","","","","","","1.011","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078927","33.225","0.009","9.898","0.003","18.448","0.004","90","","121.377","0.003","90","","5180","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C57 H72 P4 Pd -","- C57 H72 P4 Pd -","- C228 H288 P16 Pd4 -","4","0.5","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","0.71073","MoKα","","0.0505","0.0396","","","0.1189","0.1263","","","","","","1.039","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078928","33.135","0.004","9.8628","0.001","18.4542","0.0019","90","","121.312","0.002","90","","5152.5","1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C57 H72 P4 Pt -","- C57 H72 P4 Pt -","- C228 H288 P16 Pt4 -","4","0.5","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","0.71073","MoKα","","0.0418","0.0375","","","0.1002","0.102","","","","","","1.08","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078929","13.735","0.008","17.118","0.008","20.647","0.011","90","","90","","90","","4854","4","100","2","100","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C49 H76 P4 Pt -","- C49 H76 P4 Pt -","- C196 H304 P16 Pt4 -","4","0.5","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","0.71073","MoKα","","0.0198","0.018","","","0.0372","0.0379","","","","","","1.002","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078930","13.446","0.001","13.446","0.001","66.635","0.007","90","","90","","120","","10433.2","1.6","100","2","100","2","","","","","","","","7","P 65","P 65","170","","","","- C65 H88 F6 O7 P4 Pd S2 -","- C65 H88 F6 O7 P4 Pd S2 -","- C390 H528 F36 O42 P24 Pd6 S12 -","6","1","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","1.54178","CuKα","","0.0534","0.0496","","","0.1317","0.1344","","","","","","1.042","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078931","13.4616","0.0002","13.4616","0.0002","66.2129","0.0015","90","","90","","120","","10391.2","0.3","100","2","100","2","","","","","","","","7","P 61","P 61","169","","","","- C65 H88 F6 O7 P4 Pt S2 -","- C61 H78 F6 O6 P4 Pt S2 -","- C366 H468 F36 O36 P24 Pt6 S12 -","6","1","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","1.54178","CuKα","","0.0411","0.0398","","","0.0983","0.099","","","","","","1.093","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078932","11.915","0.007","13.515","0.008","21.619","0.013","73.777","0.007","77.495","0.008","68.875","0.009","3092","3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H78 F6 O6 P4 Pt S2 -","- C61 H78 F6 O6 P4 Pt S2 -","- C122 H156 F12 O12 P8 Pt2 S4 -","2","1","","Chapp, Timothy W.; Schoenfeld, Adam J.; Sanderson, Matthew D.; Chang, Cory L.; Glueck, David S.; Golen, James A.; Moore, Curtis E.; Rheingold, Arnold L.","Synthesis, Structure, Dynamics, and Selective Methylation of Platinum and Palladium Diphosphametallacyclobutane Complexes","Organometallics","2012","31","15","5573","","10.1021/om3005367","","","0.71073","MoKα","","0.0565","0.0468","","","0.1118","0.1173","","","","","","1.033","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078933","11.5032","0.0017","12.3428","0.0018","21.855","0.003","100.45","0.007","93.729","0.007","104.277","0.007","2937.6","0.7","110","2","110","2","","","","","","","","9","P -1","-P 1","2","","","","- C62 H51 Cl4 F5 N3 O3 P2 Pt Re -","- C62 H51 Cl4 F5 N3 O3 P2 Pt Re -","- C124 H102 Cl8 F10 N6 O6 P4 Pt2 Re2 -","2","1","","Clough, Melissa C.; Zeits, Paul D.; Bhuvanesh, Nattamai; Gladysz, John A.","Toward Permetalated Alkyne/Azide 3 + 2 or “Click” Cycloadducts","Organometallics","2012","31","15","5231","","10.1021/om300542a","","","1.54178","CuKα","","0.031","0.0225","","","0.0471","0.0484","","","","","","1.045","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078934","12.1623","0.0016","46.074","0.006","11.9613","0.0016","90","","90","","90","","6702.7","1.5","110","2","110","2","","","","","","","","10","P 21 21 2","P 2 2ab","18","","","","- C66 H51 Br Cl4 F5 N3 O7 P2 Pt Re2 -","- C66 H51 Br Cl4 F5 N3 O7 P2 Pt Re2 -","- C264 H204 Br4 Cl16 F20 N12 O28 P8 Pt4 Re8 -","4","1","","Clough, Melissa C.; Zeits, Paul D.; Bhuvanesh, Nattamai; Gladysz, John A.","Toward Permetalated Alkyne/Azide 3 + 2 or “Click” Cycloadducts","Organometallics","2012","31","15","5231","","10.1021/om300542a","","","0.71073","MoKα","","0.029","0.0264","","","0.0668","0.0678","","","","","","1.043","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078935","12.815","0.003","24.031","0.006","24.532","0.006","90","","102.149","0.012","90","","7386","3","296","2","296","2","","","","","","","","10","P 1 21/n 1","-P 2yn","14","","","","- C67 H50 Cl2 F8 N3 O11 P2 Pt Re2 S -","- C67 H50 Cl2 F8 N3 O11 P2 Pt Re2 S -","- C268 H200 Cl8 F32 N12 O44 P8 Pt4 Re8 S4 -","4","1","","Clough, Melissa C.; Zeits, Paul D.; Bhuvanesh, Nattamai; Gladysz, John A.","Toward Permetalated Alkyne/Azide 3 + 2 or “Click” Cycloadducts","Organometallics","2012","31","15","5231","","10.1021/om300542a","","","0.71073","MoKα","","0.0615","0.0429","","","0.0971","0.1023","","","","","","1.05","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078936","18.3638","0.0009","16.0124","0.0008","20.077","0.001","90","","117.155","0.0006","90","","5252.9","0.5","98","2","98","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H45 N2 Y -","- C27 H45 N2 Y -","- C216 H360 N16 Y8 -","8","2","","Schmiege, Benjamin M.; Fieser, Megan E.; Ziller, Joseph W.; Evans, William J.","Reactivity of the Y3+Tuck-Over Hydride Complex, (C5Me5)2Y(μ-H)(μ-CH2C5Me4)Y(C5Me5)","Organometallics","2012","31","15","5591","","10.1021/om300546t","","","0.71073","MoKα","","0.0652","0.0413","","","0.0905","0.0988","","","","","","1.031","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078937","11.4771","0.0007","14.494","0.0009","30.0175","0.0018","90","","93.559","0.001","90","","4983.8","0.5","148","2","148","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H66 F6 O6 S2 Y2 -","- C48 H66 F6 O6 S2 Y2 -","- C192 H264 F24 O24 S8 Y8 -","4","1","","Schmiege, Benjamin M.; Fieser, Megan E.; Ziller, Joseph W.; Evans, William J.","Reactivity of the Y3+Tuck-Over Hydride Complex, (C5Me5)2Y(μ-H)(μ-CH2C5Me4)Y(C5Me5)","Organometallics","2012","31","15","5591","","10.1021/om300546t","","","0.71073","MoKα","","0.0436","0.0342","","","0.0835","0.0883","","","","","","1.047","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078938","19.2433","0.0006","16.9361","0.0006","14.1667","0.0005","90","","116.072","0.0004","90","","4147.2","0.2","98","2","98","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C46 H65 Cl Y2 -","- C46 H64.98 Cl Y2 -","- C184 H259.92 Cl4 Y8 -","4","1","","Schmiege, Benjamin M.; Fieser, Megan E.; Ziller, Joseph W.; Evans, William J.","Reactivity of the Y3+Tuck-Over Hydride Complex, (C5Me5)2Y(μ-H)(μ-CH2C5Me4)Y(C5Me5)","Organometallics","2012","31","15","5591","","10.1021/om300546t","","","0.71073","MoKα","","0.0285","0.0253","","","0.0608","0.062","","","","","","1.047","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078939","9.286","0.005","9.748","0.005","16.543","0.008","101.782","0.007","96.075","0.008","90.978","0.008","1456.5","1.3","174","2","174","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H40 F3 O6 P Pd S -","- C26 H40 F3 O6 P Pd S -","- C52 H80 F6 O12 P2 Pd2 S2 -","2","1","","Shi, Yang; Brenner, Peter; Bertsch, Stefanie; Radacki, Krzysztof; Dewhurst, Rian D.","η3-Furfuryl and η3-Thienyl Complexes of Palladium and Platinum of Relevance to the Functionalization of Biomass-Derived Furans","Organometallics","2012","31","15","5599","","10.1021/om300568z","","","0.71073","MoKα","","0.0453","0.0401","","","0.0991","0.1027","","","","","","1.103","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078940","10.667","0.008","12.393","0.009","17.272","0.013","74.868","0.011","76.251","0.011","77.722","0.011","2113","3","174","2","174","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H39 B Cl2 F4 O3 P2 Pt -","- C44 H39 B Cl2 F4 O3 P2 Pt -","- C88 H78 B2 Cl4 F8 O6 P4 Pt2 -","2","1","","Shi, Yang; Brenner, Peter; Bertsch, Stefanie; Radacki, Krzysztof; Dewhurst, Rian D.","η3-Furfuryl and η3-Thienyl Complexes of Palladium and Platinum of Relevance to the Functionalization of Biomass-Derived Furans","Organometallics","2012","31","15","5599","","10.1021/om300568z","","","0.71073","MoKα","","0.0383","0.0326","","","0.0784","0.081","","","","","","1.06","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078941","9.896","0.0011","22.181","0.002","18.154","0.002","90","","96.908","0.003","90","","3955.9","0.7","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C43 H37 B Cl2 F4 O2 P2 Pd -","- C43 H37 B Cl2 F4 O2 P2 Pd -","- C172 H148 B4 Cl8 F16 O8 P8 Pd4 -","4","1","","Shi, Yang; Brenner, Peter; Bertsch, Stefanie; Radacki, Krzysztof; Dewhurst, Rian D.","η3-Furfuryl and η3-Thienyl Complexes of Palladium and Platinum of Relevance to the Functionalization of Biomass-Derived Furans","Organometallics","2012","31","15","5599","","10.1021/om300568z","","","0.71073","MoKα","","0.0762","0.0411","","","0.081","0.0913","","","","","","1.01","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078942","13.274","0.0005","16.7105","0.0004","14.4848","0.0005","90","","108.107","0.004","90","","3053.84","0.19","199.95","0.1","199.95","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H30 I3 Ir N7 Pd -","- C23 H30 I3 Ir N7 Pd -","- C92 H120 I12 Ir4 N28 Pd4 -","4","2","","Gonell, Sergio; Poyatos, Macarena; Mata, José A.; Peris, Eduardo","Y-Shaped Tris-N-Heterocyclic-Carbene Ligand for the Preparation of Multifunctional Catalysts of Iridium, Rhodium, and Palladium","Organometallics","2012","31","15","5606","","10.1021/om300569w","","","0.7107","MoKα","","0.063","0.043","","","0.0525","0.0582","","","","","","1.026","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078943","10.4283","0.0003","12.2666","0.0003","11.9217","0.0003","90","","96.174","0.002","90","","1516.18","0.07","200","0.1","200","0.1","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C23 H31 I3 N6 O2 Rh2 -","- C23 H31 I3 N6 O2 Rh2 -","- C46 H62 I6 N12 O4 Rh4 -","2","0.5","","Gonell, Sergio; Poyatos, Macarena; Mata, José A.; Peris, Eduardo","Y-Shaped Tris-N-Heterocyclic-Carbene Ligand for the Preparation of Multifunctional Catalysts of Iridium, Rhodium, and Palladium","Organometallics","2012","31","15","5606","","10.1021/om300569w","","","0.7107","MoKα","","0.0541","0.0356","","","0.0823","0.0936","","","","","","1.065","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078944","10.991","0.001","14.022","0.001","17.523","0.001","90","","99.068","0.001","90","","2666.8","0.3","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H34 N2 P2 Sm -","- C26 H34 N2 P2 Sm -","- C104 H136 N8 P8 Sm4 -","4","1","","Labouille, Stéphanie; Nief, François; Le Goff, Xavier-Frédéric; Maron, Laurent; Kindra, Douglas R.; Houghton, Heidi L.; Ziller, Joseph W.; Evans, William J.","Ligand Influence on the Redox Chemistry of Organosamarium Complexes: Experimental and Theoretical Studies of the Reactions of (C5Me5)2Sm(THF)2and (C4Me4P)2Sm with Pyridine and Acridine","Organometallics","2012","31","14","5196","","10.1021/om300573z","","","0.71069","MoKα","","0.0459","0.0364","","","0.0838","0.0897","","","","","","1.123","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078945","10.1899","0.0006","14.1166","0.0009","22.5205","0.0014","90","","95.9632","0.0007","90","","3222","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C74 H96 N4 Sm2 -","- C74 H96 N4 Sm2 -","- C148 H192 N8 Sm4 -","2","0.5","","Labouille, Stéphanie; Nief, François; Le Goff, Xavier-Frédéric; Maron, Laurent; Kindra, Douglas R.; Houghton, Heidi L.; Ziller, Joseph W.; Evans, William J.","Ligand Influence on the Redox Chemistry of Organosamarium Complexes: Experimental and Theoretical Studies of the Reactions of (C5Me5)2Sm(THF)2and (C4Me4P)2Sm with Pyridine and Acridine","Organometallics","2012","31","14","5196","","10.1021/om300573z","","","0.71073","MoKα","","0.0236","0.0206","","","0.051","0.0527","","","","","","1.03","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078946","27.985","0.001","16.497","0.001","23.894","0.001","90","","105.501","0.001","90","","10629.9","0.9","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H66 N2 P4 Sm2 -","- C58 H66 N2 P4 Sm2 -","- C464 H528 N16 P32 Sm16 -","8","1","","Labouille, Stéphanie; Nief, François; Le Goff, Xavier-Frédéric; Maron, Laurent; Kindra, Douglas R.; Houghton, Heidi L.; Ziller, Joseph W.; Evans, William J.","Ligand Influence on the Redox Chemistry of Organosamarium Complexes: Experimental and Theoretical Studies of the Reactions of (C5Me5)2Sm(THF)2and (C4Me4P)2Sm with Pyridine and Acridine","Organometallics","2012","31","14","5196","","10.1021/om300573z","","","0.71069","MoKα","","0.1037","0.0874","","","0.2383","0.2494","","","","","","1.075","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078947","9.5014","0.0006","16.8738","0.001","17.3714","0.001","64.013","0.001","88.208","0.001","78.191","0.001","2445.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H86 Li4 N7 Si4 -","- C37 H86 Li4 N7 Si4 -","- C74 H172 Li8 N14 Si8 -","2","1","","Tatić, Tanja; Hermann, Stefanie; Stalke, Dietmar","The [(DABCO)7·(LiCH2SiMe3)8] Octamer: More Aggregated than the Parent Starting Material [LiCH2SiMe3]6but Also Higher in Reactivity","Organometallics","2012","31","15","5615","","10.1021/om3005806","","","0.71073","MoKα","","0.0483","0.0361","","","0.0899","0.0965","","","","","","1.048","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078948","11.7666","0.001","16.057","0.0013","12.2524","0.001","90","","90.028","0.001","90","","2314.9","0.3","99","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H38 Li2 N4 -","- C26 H38 Li2 N4 -","- C104 H152 Li8 N16 -","4","2","","Tatić, Tanja; Hermann, Stefanie; Stalke, Dietmar","The [(DABCO)7·(LiCH2SiMe3)8] Octamer: More Aggregated than the Parent Starting Material [LiCH2SiMe3]6but Also Higher in Reactivity","Organometallics","2012","31","15","5615","","10.1021/om3005806","","","0.71073","MoKα","","0.0379","0.0367","","","0.0993","0.1006","","","","","","1.126","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078949","12.204","0.003","20.28","0.004","12.185","0.003","90","","115.654","0.003","90","","2718.5","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","rac-Dichloro[(1,2,3,3a,7a-η)-1-[2-(methylsulfanyl-κS-1-naphthyl]- 2-methyl-1H-inden-1-yl]rhodium","","- C23 H17 Cl8 D2 Rh S -","- C23 H17 Cl8 D2 Rh S -","- C92 H68 Cl32 D8 Rh4 S4 -","4","1","","Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter","Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)","Organometallics","2012","31","15","5622","","10.1021/om300581r","","","0.71073","MoKα","","0.032","0.0252","","","0.0607","0.0645","","","","","","1.05","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4078950","7.5412","0.0002","10.2627","0.0002","11.2341","0.0003","95.955","0.001","90.173","0.001","108.842","0.001","817.79","0.04","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","(aR*,R~s~*)-1-(2-Methyl-1H-inden-3-yl)-2-(methylsulfinyl)naphthalene","","- C21 H18 O S -","- C21 H18 O S -","- C42 H36 O2 S2 -","2","1","","Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter","Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)","Organometallics","2012","31","15","5622","","10.1021/om300581r","","","0.71073","MoKα","","0.0391","0.035","","","0.1","0.1043","","","","","","1.068","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078951","14.2599","0.0001","21.481","0.0002","31.5683","0.0003","90","","90","","90","","9669.9","0.15","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(pR*,S~S~*)-Dichloro[(1,2,3,3a,7a-η)-1-[2-(methylsulfinyl-κS)-naphthyl]- 2-methyl-1H-inden-1-yl]rhodium","","- C26.45 H22.5 Cl2.1 O Rh S -","- C26.45 H22.5 Cl2.1 O Rh S -","- C423.2 H360 Cl33.6 O16 Rh16 S16 -","16","2","","Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter","Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)","Organometallics","2012","31","15","5622","","10.1021/om300581r","","","0.71073","MoKα","","0.0391","0.0328","","","0.095","0.1002","","","","","","1.485","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4078952","12.3101","0.0009","10.2161","0.0007","18.6589","0.0013","90","","91.306","0.003","90","","2346","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","(pR*,R~S~*)-Dichloro[(1,2,3,3a,7a-η)-1-[2-(methylsulfinyl-κS)-1-naphthyl]- 2-methyl-1H-inden-1-yl]rhodium","","- C22 H17 Cl5 D O Rh S -","- C22 H17 Cl5 D O Rh S -","- C88 H68 Cl20 D4 O4 Rh4 S4 -","4","1","","Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter","Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)","Organometallics","2012","31","15","5622","","10.1021/om300581r","","","0.71073","MoKα","","0.0266","0.0205","","","0.061","0.0816","","","","","","1.349","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078953","10.69015","0.00018","14.5286","0.0002","15.0235","0.0002","90","","90","","90","","2333.34","0.06","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(pS,S~S~)-Dichloro[(1,2,3,3a,7a-η)-1-[2-(methylsulfinyl-κS)-1-naphthyl]- 2-methyl-1H-inden-1-yl]rhodium","","- C27 H23 Cl2 O Rh S -","- C27 H23 Cl2 O Rh S -","- C108 H92 Cl8 O4 Rh4 S4 -","4","1","","Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter","Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)","Organometallics","2012","31","15","5622","","10.1021/om300581r","","","0.71073","MoKα","","0.0542","0.0385","","","0.0449","0.0474","","","","","","1.201","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078954","10.9155","0.0007","9.966","0.0007","11.6419","0.0008","90","","115.278","0.002","90","","1145.18","0.14","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H10 B F15 -","- C24 H10 B F15 -","- C48 H20 B2 F30 -","2","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.0356","0.0294","","","0.0655","0.0688","","","","","","1.024","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078955","11.2573","0.0006","11.8997","0.0006","15.2899","0.0008","78.641","0.003","71.732","0.003","67.422","0.002","1789.05","0.17","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H33 B F15 P -","- C38 H33 B F15 P -","- C76 H66 B2 F30 P2 -","2","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.0947","0.0566","","","0.1349","0.1546","","","","","","1.018","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078956","11.2252","0.0003","18.7357","0.0005","19.1203","0.0006","90","","90","","90","","4021.2","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H37 B F15 P -","- C44 H37 B F15 P -","- C176 H148 B4 F60 P4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.0541","0.0459","","","0.115","0.1211","","","","","","1.05","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078957","18.4883","0.001","18.5351","0.0011","19.2487","0.0011","90","","90","","90","","6596.2","0.7","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H31 B F15 P -","- C33 H31 B F15 P -","- C264 H248 B8 F120 P8 -","8","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.0766","0.0516","","","0.1332","0.1501","","","","","","1.039","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078958","11.0573","0.0006","13.0147","0.0007","13.9942","0.0007","81.889","0.002","88.595","0.003","85.825","0.002","1988.23","0.18","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H31 B F15 P -","- C41 H31 B F15 P -","- C82 H62 B2 F30 P2 -","2","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.085","0.0579","","","0.1539","0.1728","","","","","","1.045","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078959","9.8745","0.0006","18.2413","0.001","23.7744","0.0013","90","","90","","90","","4282.3","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C47 H36 B F15 P -","- C47 H36 B F15 P -","- C188 H144 B4 F60 P4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.111","0.0728","","","0.189","0.2161","","","","","","1.03","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078960","9.9252","0.0003","20.0004","0.0011","18.3802","0.0007","90","","93.002","0.003","90","","3643.6","0.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H39 B F15 P -","- C35 H39 B F15 P -","- C140 H156 B4 F60 P4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","1.54178","CuKα","","0.1015","0.0889","","","0.2526","0.2672","","","","","","1.05","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078961","37.44","0.003","9.7274","0.0006","24.1227","0.0017","90","","120.714","0.003","90","","7553","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H37 B F15 P -","- C38 H37 B F15 P -","- C304 H296 B8 F120 P8 -","8","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.0889","0.0528","","","0.1185","0.1413","","","","","","1.013","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078962","10.2586","0.0003","12.1826","0.0005","16.1736","0.0005","89.894","0.003","77.848","0.002","71.794","0.004","1872.65","0.12","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H39 B F15 P -","- C36 H39 B F15 P -","- C72 H78 B2 F30 P2 -","2","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","1.54178","CuKα","","0.0769","0.0729","","","0.2153","0.2201","","","","","","1.051","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078963","8.8564","0.001","12.5788","0.0015","17.423","0.002","81.339","0.005","79.73","0.005","73.098","0.006","1817.3","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H39 B F15 P -","- C36 H39 B F15 P -","- C72 H78 B2 F30 P2 -","2","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","0.71073","MoKα","","0.1142","0.0507","","","0.0947","0.1169","","","","","","1.004","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078964","13.2049","0.0003","16.7532","0.0004","17.8062","0.0006","90","","98.306","0.002","90","","3897.85","0.18","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H43 B F15 P -","- C38 H43 B F15 P -","- C152 H172 B4 F60 P4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","1.54178","CuKα","","0.0466","0.0415","","","0.1059","0.1103","","","","","","1.047","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078965","13.3052","0.0002","15.4057","0.0004","20.3224","0.0005","90","","90","","90","","4165.6","0.16","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H39 B F15 P -","- C44 H39 B F15 P -","- C176 H156 B4 F60 P4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","1.54178","CuKα","","0.0363","0.0352","","","0.0848","0.0858","","","","","","1.052","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078966","9.5401","0.0003","19.9821","0.0006","17.8109","0.0005","90","","97.067","0.002","90","","3369.52","0.17","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34.5 H29 B F15 N -","- C34.5 H29 B F15 N -","- C138 H116 B4 F60 N4 -","4","1","","Reddy, J. Sreedhar; Xu, Bao-Hua; Mahdi, Tayseer; Fröhlich, Roland; Kehr, Gerald; Stephan, Douglas W.; Erker, Gerhard","Alkenylborane-Derived Frustrated Lewis Pairs: Metal-Free Catalytic Hydrogenation Reactions of Electron-Deficient Alkenes","Organometallics","2012","31","15","5638","","10.1021/om3006068","","","1.54178","CuKα","","0.0678","0.0576","","","0.1587","0.169","","","","","","1.028","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078967","9.5328","0.001","10.7889","0.0011","11.9834","0.0012","90","","90","","90","","1232.5","0.2","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C48 H64 N8 O12 -","4","1","","Fernández-Moreira, Vanesa; Ortego, M. Lourdes; Williams, Catrin F.; Coogan, Michael P.; Villacampa, M. Dolores; Gimeno, M. Concepción","Bioconjugated Rhenium(I) Complexes with Amino Acid Derivatives: Synthesis, Photophysical Properties, and Cell Imaging Studies","Organometallics","2012","31","16","5950","","10.1021/om300610j","","","0.71073","MoKα","","0.0365","0.0333","","","0.0758","0.0775","","","","","","1.064","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078968","8.88","0.0018","24.12","0.005","13.24","0.003","90","","96.9","0.03","90","","2815.3","1.1","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H25 B F4 N4 O6.5 Re -","- C25 H24 B F4 N4 O6.5 Re -","- C100 H96 B4 F16 N16 O26 Re4 -","4","2","","Fernández-Moreira, Vanesa; Ortego, M. Lourdes; Williams, Catrin F.; Coogan, Michael P.; Villacampa, M. Dolores; Gimeno, M. Concepción","Bioconjugated Rhenium(I) Complexes with Amino Acid Derivatives: Synthesis, Photophysical Properties, and Cell Imaging Studies","Organometallics","2012","31","16","5950","","10.1021/om300610j","","","0.71073","MoKα","","0.0683","0.0516","","","0.0953","0.1011","","","","","","1.047","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078969","9.582","0.0019","20.496","0.004","10.647","0.002","90","","106.92","0.03","90","","2000.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 N4 O3 P Pd -","- C18 H23 N4 O4 P Pd -","- C72 H92 N16 O16 P4 Pd4 -","4","1","","Carreira, Monica; Calvo-Sanjuán, Rubén; Sanaú, Mercedes; Marzo, Isabel; Contel, María","Organometallic Palladium Complexes with a Water-Soluble Iminophosphorane Ligand as Potential Anticancer Agents.","Organometallics","2012","31","16","5772","5781","10.1021/om3006239","","","0.71073","MoKα","","0.0546","0.0376","","","0.0968","0.1049","","","","","","1.079","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078970","10.0815","0.0001","12.1604","0.0001","19.4771","0.0002","83.6939","0.0004","87.4709","0.0004","78.233","0.0004","2322.89","0.04","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C45 H52 B11 O2 P2 Rh S -","- C45 H52 B11 O2 P2 Rh S -","- C90 H104 B22 O4 P4 Rh2 S2 -","2","1","","Pawley, Rebekah J.; Huertos, Miguel A.; Lloyd-Jones, Guy C.; Weller, Andrew S.; Willis, Michael C.","Intermolecular Alkyne Hydroacylation. Mechanistic Insight from the Isolation of the Vinyl Intermediate That Precedes Reductive Elimination","Organometallics","2012","31","15","5650","","10.1021/om300647n","","","0.71073","MoKα","","0.0358","0.0294","","","0.069","0.072","","","","","","1.047","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078971","39.9424","0.0002","15.1952","0.0001","26.721","0.0002","90","","130.985","0.0004","90","","12242.5","0.16","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C119 H122 B22 F12 O7 P4 Rh2 S2 -","- C119 H122 B22 F12 O7 P4 Rh2 S2 -","- C476 H488 B88 F48 O28 P16 Rh8 S8 -","4","0.5","","Pawley, Rebekah J.; Huertos, Miguel A.; Lloyd-Jones, Guy C.; Weller, Andrew S.; Willis, Michael C.","Intermolecular Alkyne Hydroacylation. Mechanistic Insight from the Isolation of the Vinyl Intermediate That Precedes Reductive Elimination","Organometallics","2012","31","15","5650","","10.1021/om300647n","","","0.71073","MoKα","","0.073","0.0392","","","0.0917","0.1045","","","","","","1.021","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078972","14.313","0.0002","15.7419","0.0002","16.9697","0.00029","104.206","0.0007","113.972","0.0006","105.794","0.0007","3073.92","0.09","150","2","150","2","","","","","","","","9","P -1","-P 1","2","","","","- C56 H56 B12 Cl4 F6 O2 P2 Rh S -","- C56 H56 B12 Cl4 F6 O2 P2 Rh S -","- C112 H112 B24 Cl8 F12 O4 P4 Rh2 S2 -","2","1","","Pawley, Rebekah J.; Huertos, Miguel A.; Lloyd-Jones, Guy C.; Weller, Andrew S.; Willis, Michael C.","Intermolecular Alkyne Hydroacylation. Mechanistic Insight from the Isolation of the Vinyl Intermediate That Precedes Reductive Elimination","Organometallics","2012","31","15","5650","","10.1021/om300647n","","","0.71073","MoKα","","0.061","0.0446","","","0.1066","0.1163","","","","","","1.033","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078973","8.9977","0.0003","10.3307","0.0003","10.6084","0.0003","91.332","0.001","110.575","0.001","98.511","0.001","909.99","0.05","150","2","150","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H30 Cl N O Os P2 -","- C13 H30 Cl N O Os P2 -","- C26 H60 Cl2 N2 O2 Os2 P4 -","2","1","","Spasyuk, Denis; Gusev, Dmitry G.","Acceptorless Dehydrogenative Coupling of Ethanol and Hydrogenation of Esters and Imines","Organometallics","2012","31","15","5239","","10.1021/om300670r","","","1.54178","CuKα","","0.0312","0.031","","","0.0805","0.0806","","","","","","1.164","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078974","10.5195","0.0003","13.2513","0.0003","16.3644","0.0004","68.972","0.001","88.622","0.001","67.031","0.001","1942.49","0.09","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H36 Cl2 N2 P2 Ru -","- C38 H36 Cl2 N2 P2 Ru -","- C76 H72 Cl4 N4 P4 Ru2 -","2","1","","Spasyuk, Denis; Gusev, Dmitry G.","Acceptorless Dehydrogenative Coupling of Ethanol and Hydrogenation of Esters and Imines","Organometallics","2012","31","15","5239","","10.1021/om300670r","","","1.54178","CuKα","","0.0299","0.0297","","","0.0765","0.0767","","","","","","0.975","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078975","10.2766","0.0003","17.9182","0.0005","20.3739","0.0005","90","","90","","90","","3751.61","0.18","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H58 Cl N6 Nb -","- C33 H58 Cl N6 Nb -","- C132 H232 Cl4 N24 Nb4 -","4","1","","Perera, T. Hiran; Lord, Richard L.; Heeg, Mary Jane; Schlegel, H. Bernhard; Winter, Charles H.","Metallapyrimidines and Metallapyrimidiniums from Oxidative Addition of Pyrazolate N‒N Bonds to Niobium(III), Niobium(IV), and Tantalum(IV) Metal Centers and Assessment of Their Aromatic Character","Organometallics","2012","31","17","5971","","10.1021/om300490w","","","0.71073","MoKα","","0.0281","0.0261","","","0.0598","0.0606","","","","","","1.047","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078976","10.2318","0.0003","17.9282","0.0005","20.2874","0.0006","90","","90","","90","","3721.48","0.19","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H58 Cl N6 Ta -","- C33 H58 Cl N6 Ta -","- C132 H232 Cl4 N24 Ta4 -","4","1","","Perera, T. Hiran; Lord, Richard L.; Heeg, Mary Jane; Schlegel, H. Bernhard; Winter, Charles H.","Metallapyrimidines and Metallapyrimidiniums from Oxidative Addition of Pyrazolate N‒N Bonds to Niobium(III), Niobium(IV), and Tantalum(IV) Metal Centers and Assessment of Their Aromatic Character","Organometallics","2012","31","17","5971","","10.1021/om300490w","","","0.71073","MoKα","","0.0209","0.0192","","","0.0398","0.0402","","","","","","0.989","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078977","9.5471","0.0009","17.2627","0.0015","21.1366","0.0019","90","","90","","90","","3483.5","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H57 N6 Nb -","- C33 H57 N6 Nb -","- C132 H228 N24 Nb4 -","4","1","","Perera, T. Hiran; Lord, Richard L.; Heeg, Mary Jane; Schlegel, H. Bernhard; Winter, Charles H.","Metallapyrimidines and Metallapyrimidiniums from Oxidative Addition of Pyrazolate N‒N Bonds to Niobium(III), Niobium(IV), and Tantalum(IV) Metal Centers and Assessment of Their Aromatic Character","Organometallics","2012","31","17","5971","","10.1021/om300490w","","","0.71073","MoKα","","0.0449","0.0417","","","0.1096","0.112","","","","","","1.119","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078978","12.43","0.004","14.089","0.004","13.738","0.004","90","","110.342","0.006","90","","2255.8","1.2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C44 H58 N10 Ti2 -","- C44 H58 N10 Ti2 -","- C88 H116 N20 Ti4 -","2","0.5","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C‒C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.7107","MoKα","","0.118","0.0998","","","0.2485","0.259","","","","","","1.207","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078979","11.623","0.002","18.586","0.004","11.286","0.002","90","","93.94","0.03","90","","2432.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 N4 O3 Ti -","- C28 H28 N4 O3 Ti -","- C112 H112 N16 O12 Ti4 -","4","1","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C–C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.0833","0.0512","","","0.1365","0.1568","","","","","","1.042","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078980","8.9558","0.0007","12.3665","0.001","12.5926","0.0016","111.759","0.006","103.185","0.006","106.276","0.004","1154","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H66 N10 Ti2 -","- C43 H66 N10 Ti2 -","- C43 H66 N10 Ti2 -","1","0.5","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C–C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.055","0.0477","","","0.1382","0.1439","","","","","","1.025","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4078981","11.929","0.005","15.792","0.008","10.267","0.005","90","","90","","90","","1934.1","1.6","296","2","296","2","","","","","","","","5","P n n 2","P 2 -2n","34","","","","- C16 H27 N5 O Ti -","- C16 H27 N5 O Ti -","- C64 H108 N20 O4 Ti4 -","4","1","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C–C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.1191","0.0825","","","0.1917","0.2196","","","","","","1.011","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078982","10.383","0.004","15.316","0.005","25.274","0.01","90","","90","","90","","4019","3","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H31 N5 O Ti -","- C16 H31 N5 O Ti -","- C128 H248 N40 O8 Ti8 -","8","1","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C–C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.1555","0.0548","","","0.0906","0.1182","","","","","","0.974","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078983","11.9343","0.0011","5.9347","0.0005","20.295","0.0018","90","","97.229","0.007","90","","1426","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 N4 O4 -","- C30 H34 N4 O4 -","- C60 H68 N8 O8 -","2","0.5","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C‒C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.0595","0.0481","","","0.1268","0.137","","","","","","1.066","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078984","19.8643","0.0006","9.0349","0.0002","24.8875","0.0007","90","","106.793","0.002","90","","4276.1","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H60 N8 O3 Ti2 -","- C41 H60 N8 O3 Ti2 -","- C164 H240 N32 O12 Ti8 -","4","1","","Chen, Zhou; Wu, Jian; Chen, Yanmei; Li, Lei; Xia, Yuanzhi; Li, Yahong; Liu, Wei; Lei, Tao; Yang, Lijuan; Gao, Dandan; Li, Wu","Rapid Access to Substituted Piperazines via Ti(NMe2)4-Mediated C–C Bond-Making Reactions","Organometallics","2012","31","17","6005","","10.1021/om300022u","","","0.71073","MoKα","","0.1023","0.0529","","","0.1179","0.1404","","","","","","0.993","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078985","14.578","0.002","9.9726","0.0017","19.017","0.003","90","","103.389","0.003","90","","2689.6","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H44 N3 O0 Sc Si2 -","- C22 H44 N3 Sc Si2 -","- C88 H176 N12 Sc4 Si8 -","4","1","","Wang, Lingfang; Liu, Dongtao; Cui, Dongmei","NNN-Tridentate Pyrrolyl Rare-Earth Metal Complexes: Structure and Catalysis on Specific Selective Living Polymerization of Isoprene","Organometallics","2012","31","17","6014","","10.1021/om300049h","","","0.71073","MoKα","","0.1363","0.076","","","0.1708","0.1982","","","","","","1.052","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078986","17.363","0.0017","10.3511","0.001","18.2635","0.0018","90","","109.731","0.001","90","","3089.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H52 N3 O Si2 Y -","- C26 H52 N3 O Si2 Y -","- C104 H208 N12 O4 Si8 Y4 -","4","1","","Wang, Lingfang; Liu, Dongtao; Cui, Dongmei","NNN-Tridentate Pyrrolyl Rare-Earth Metal Complexes: Structure and Catalysis on Specific Selective Living Polymerization of Isoprene","Organometallics","2012","31","17","6014","","10.1021/om300049h","","","0.71073","MoKα","","0.052","0.0352","","","0.0763","0.0817","","","","","","1.023","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078987","17.339","0.001","10.3224","0.0006","18.2415","0.001","90","","109.855","0.001","90","","3070.8","0.3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C26 H52 Cl0 Li0 Lu N3 O Si2 -","- C26 H52 Lu N3 O Si2 -","- C104 H208 Lu4 N12 O4 Si8 -","4","1","","Wang, Lingfang; Liu, Dongtao; Cui, Dongmei","NNN-Tridentate Pyrrolyl Rare-Earth Metal Complexes: Structure and Catalysis on Specific Selective Living Polymerization of Isoprene","Organometallics","2012","31","17","6014","","10.1021/om300049h","","","0.71073","MoKα","","0.0339","0.025","","","0.056","0.0592","","","","","","1.042","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078988","10.7012","0.0005","19.0875","0.0008","28.4803","0.0012","90","","90","","90","","5817.4","0.4","11","2","11","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H48 N3 O0 Sc Si2 -","- C24 H48 N3 Sc Si2 -","- C192 H384 N24 Sc8 Si16 -","8","1","","Wang, Lingfang; Liu, Dongtao; Cui, Dongmei","NNN-Tridentate Pyrrolyl Rare-Earth Metal Complexes: Structure and Catalysis on Specific Selective Living Polymerization of Isoprene","Organometallics","2012","31","17","6014","","10.1021/om300049h","","","0.71073","MoKα","","0.059","0.0487","","","0.1345","0.1433","","","","","","1.037","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078989","11.7302","0.0005","15.902","0.0007","17.1849","0.0007","89.594","0.001","73.108","0.001","70.807","0.001","2882.9","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H96 N6 O0 Si4 Y2 -","- C48 H96 N6 Si4 Y2 -","- C96 H192 N12 Si8 Y4 -","2","1","","Wang, Lingfang; Liu, Dongtao; Cui, Dongmei","NNN-Tridentate Pyrrolyl Rare-Earth Metal Complexes: Structure and Catalysis on Specific Selective Living Polymerization of Isoprene","Organometallics","2012","31","17","6014","","10.1021/om300049h","","","0.71073","MoKα","","0.0717","0.0416","","","0.0954","0.1073","","","","","","1.017","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078990","26.4378","0.0011","8.7798","0.0004","26.8273","0.001","90","","93.831","0.002","90","","6213.2","0.4","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H68 F N9 O12 Si8 -","- C40 H68 F N9 O12 Si8 -","- C160 H272 F4 N36 O48 Si32 -","4","0.5","","El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Horton, Peter N.; Stephenson, Richard A.; Hursthouse, Michael B.","Facile Synthesis of Novel Functionalized Silsesquioxane Nanostructures Containing an Encapsulated Fluoride Anion","Organometallics","2012","31","17","6032","","10.1021/om300277g","","","0.71073","MoKα","","0.0673","0.0541","","","0.135","0.1436","","","","","","1.067","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078991","12.4124","0.0004","14.7103","0.0005","35.5306","0.0013","90","","95.666","0.002","90","","6455.8","0.4","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H84 F N9 O12 Si8 -","- C48 H84 F N9 O12 Si8 -","- C192 H336 F4 N36 O48 Si32 -","4","1","","El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Horton, Peter N.; Stephenson, Richard A.; Hursthouse, Michael B.","Facile Synthesis of Novel Functionalized Silsesquioxane Nanostructures Containing an Encapsulated Fluoride Anion","Organometallics","2012","31","17","6032","","10.1021/om300277g","","","0.71073","MoKα","","0.1378","0.0716","","","0.1801","0.2157","","","","","","1.083","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078992","10.2479","0.0003","12.5527","0.0004","15.9489","0.0005","105.062","0.002","106.841","0.002","101.499","0.002","1810.55","0.11","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H92 F N O28 Si8 -","- C56 H92 F N O28 Si8 -","- C56 H92 F N O28 Si8 -","1","0.5","","El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Horton, Peter N.; Stephenson, Richard A.; Hursthouse, Michael B.","Facile Synthesis of Novel Functionalized Silsesquioxane Nanostructures Containing an Encapsulated Fluoride Anion","Organometallics","2012","31","17","6032","","10.1021/om300277g","","","0.71073","MoKα","","0.0706","0.0455","","","0.1089","0.1206","","","","","","1.046","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078993","8.6557","0.0002","11.7528","0.0002","12.4208","0.0002","106.041","0.001","98.006","0.001","96.123","0.001","1188.45","0.04","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 F N9 O12 Si8 -","- C32 H52 F N9 O12 Si8 -","- C32 H52 F N9 O12 Si8 -","1","0.5","","El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Horton, Peter N.; Stephenson, Richard A.; Hursthouse, Michael B.","Facile Synthesis of Novel Functionalized Silsesquioxane Nanostructures Containing an Encapsulated Fluoride Anion","Organometallics","2012","31","17","6032","","10.1021/om300277g","","","0.71073","MoKα","","0.0388","0.0342","","","0.1053","0.1083","","","","","","1.16","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078994","20.5416","0.0002","14.5201","0.0002","25.3577","0.0003","90","","111.36","0.001","90","","7043.82","0.15","160","2","160","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H92 F N O28 Si8 -","- C48 H92 F N O28 Si8 -","- C192 H368 F4 N4 O112 Si32 -","4","0.5","","El Aziz, Youssef; Bassindale, Alan R.; Taylor, Peter G.; Horton, Peter N.; Stephenson, Richard A.; Hursthouse, Michael B.","Facile Synthesis of Novel Functionalized Silsesquioxane Nanostructures Containing an Encapsulated Fluoride Anion","Organometallics","2012","31","17","6032","","10.1021/om300277g","","","0.71073","MoKα","","0.0487","0.0433","","","0.1117","0.1153","","","","","","1.036","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4078995","21.262","0.004","9.4135","0.0017","17.715","0.003","90","","92.592","0.003","90","","3542","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H47 Cl N2 Pd -","- C39 H47 Cl N2 Pd -","- C156 H188 Cl4 N8 Pd4 -","4","1","","Guo, Lihua; Gao, Haiyang; Guan, Qirui; Hu, Haibin; Deng, Juean; Liu, Jun; Liu, Fengshou; Wu, Qing","Substituent Effects of the Backbone in α-Diimine Palladium Catalysts on Homo- and Copolymerization of Ethylene with Methyl Acrylate","Organometallics","2012","31","17","6054","","10.1021/om300380b","","","0.71073","MoKα","","0.1154","0.0587","","","0.1393","0.1673","","","","","","1.038","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078996","10.0707","0.001","40.419","0.004","18.8682","0.0015","90","","111.797","0.004","90","","7131.2","1.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H45 Cl F2 N2 Pd -","- C39 H45 Cl F2 N2 Pd -","- C312 H360 Cl8 F16 N16 Pd8 -","8","2","","Guo, Lihua; Gao, Haiyang; Guan, Qirui; Hu, Haibin; Deng, Juean; Liu, Jun; Liu, Fengshou; Wu, Qing","Substituent Effects of the Backbone in α-Diimine Palladium Catalysts on Homo- and Copolymerization of Ethylene with Methyl Acrylate","Organometallics","2012","31","17","6054","","10.1021/om300380b","","","0.71073","MoKα","","0.0902","0.0684","","","0.1777","0.1914","","","","","","1.226","","","","has coordinates","178678","2020-10-21","18:00:00",""
"4078997","28.532","0.003","14.8505","0.0015","35.569","0.004","90","","106.844","0.002","90","","14425","3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C71 H69 B F24 N2 O2 Pd -","- C71 H68 B F24 N2 O2 Pd -","- C568 H544 B8 F192 N16 O16 Pd8 -","8","2","","Guo, Lihua; Gao, Haiyang; Guan, Qirui; Hu, Haibin; Deng, Juean; Liu, Jun; Liu, Fengshou; Wu, Qing","Substituent Effects of the Backbone in α-Diimine Palladium Catalysts on Homo- and Copolymerization of Ethylene with Methyl Acrylate","Organometallics","2012","31","17","6054","","10.1021/om300380b","","","0.71073","MoKα","","0.212","0.1149","","","0.3035","0.3725","","","","","","1.099","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078998","16.721","","17.548","","24.927","","74.65","","87.55","","76.33","","6851.84","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C127 H88 B2 F48 N4 O Pd -","- C127.3 H87.92 B2 F48 N4 O0.53 Pd -","- C254.6 H175.84 B4 F96 N8 O1.06 Pd2 -","2","1","","Guo, Lihua; Gao, Haiyang; Guan, Qirui; Hu, Haibin; Deng, Juean; Liu, Jun; Liu, Fengshou; Wu, Qing","Substituent Effects of the Backbone in α-Diimine Palladium Catalysts on Homo- and Copolymerization of Ethylene with Methyl Acrylate","Organometallics","2012","31","17","6054","","10.1021/om300380b","","","0.71073","MoKα","","0.1726","0.0984","","","0.2778","0.3422","","","","","","1.1","","","","has coordinates,has disorder","178678","2020-10-21","18:00:00",""
"4078999","10.944","0.003","14.793","0.005","16.344","0.003","96.38","0.02","100.07","0.02","110.888","0.019","2390.4","1.2","90","2","90","2","","","","","","","","5","P -1","-P 1","2","2-[dihydroxy(mesityl)silyl]-N,N-diisopropylnaphthalene-1-carboxamide with water solvate","","","- C26 H34 N O3.5 Si -","- C26 H34 N O3.5 Si -","- C104 H136 N4 O14 Si4 -","4","2","","Wilson, Sean O.; Tran, Ngon T.; Franz, Annaliese K.","NMR and X-ray Studies of Hydrogen Bonding for Amide-Containing Silanediols","Organometallics","2012","31","19","6715","6718","10.1021/om300736n","","","0.71073","MoKα","","0.1105","0.05","","","0.1005","0.124","","","","","","0.988","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079000","11.4203","0.0003","15.1266","0.0004","18.8794","0.0005","78.036","0.001","76.063","0.001","87.36","0.001","3096.63","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H96 N4 Ni O4 P4 -","- C64 H96 N4 Ni O4 P4 -","- C128 H192 N8 Ni2 O8 P8 -","2","1","","Lense, Sheri; Ho, Ming-Hsun; Chen, Shentan; Jain, Avijita; Raugei, Simone; Linehan, John C.; Roberts, John A. S.; Appel, Aaron M.; Shaw, Wendy","Incorporating Amino Acid Esters into Catalysts for Hydrogen Oxidation: Steric and Electronic Effects and the Role of Water as a Base","Organometallics","2012","31","19","6719","6731","10.1021/om300409y","","","0.71073","MoKα","","0.0967","0.0507","","","0.1173","0.1371","","","","","","1.017","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079001","11.0372","0.0005","20.2569","0.0009","25.6373","0.0012","90","","96.63","0.002","90","","5693.6","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H44 N2 Ni0.5 P2 -","- C30 H44 N2 Ni0.5 P2 -","- C240 H352 N16 Ni4 P16 -","8","1","","Lense, Sheri; Ho, Ming-Hsun; Chen, Shentan; Jain, Avijita; Raugei, Simone; Linehan, John C.; Roberts, John A. S.; Appel, Aaron M.; Shaw, Wendy","Incorporating Amino Acid Esters into Catalysts for Hydrogen Oxidation: Steric and Electronic Effects and the Role of Water as a Base","Organometallics","2012","31","19","6719","6731","10.1021/om300409y","","","0.71073","MoKα","","0.0524","0.0364","","","0.0887","0.0955","","","","","","1.025","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079002","11.5233","0.0006","24.1947","0.0012","27.2777","0.0014","64.052","0.003","77.942","0.003","87.822","0.003","6675.2","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H96 N4 Ni O8 P4 -","- C68 H96 N4 Ni O8 P4 -","- C272 H384 N16 Ni4 O32 P16 -","4","2","","Lense, Sheri; Ho, Ming-Hsun; Chen, Shentan; Jain, Avijita; Raugei, Simone; Linehan, John C.; Roberts, John A. S.; Appel, Aaron M.; Shaw, Wendy","Incorporating Amino Acid Esters into Catalysts for Hydrogen Oxidation: Steric and Electronic Effects and the Role of Water as a Base","Organometallics","2012","31","19","6719","6731","10.1021/om300409y","","","0.71073","MoKα","","0.1555","0.0622","","","0.1117","0.1348","","","","","","1.035","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079003","22.1067","0.0014","15.5747","0.0011","22.938","0.0017","90","","109.805","0.003","90","","7430.5","0.9","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C72 H102 B2 F8 N6 Ni O9 P4 -","- C72 H102 B2 F8 N6 Ni O9 P4 -","- C288 H408 B8 F32 N24 Ni4 O36 P16 -","4","1","","Lense, Sheri; Ho, Ming-Hsun; Chen, Shentan; Jain, Avijita; Raugei, Simone; Linehan, John C.; Roberts, John A. S.; Appel, Aaron M.; Shaw, Wendy","Incorporating Amino Acid Esters into Catalysts for Hydrogen Oxidation: Steric and Electronic Effects and the Role of Water as a Base","Organometallics","2012","31","19","6719","6731","10.1021/om300409y","","","0.71073","MoKα","","0.1192","0.0819","","","0.2073","0.2273","","","","","","1.096","","","","has coordinates,has disorder","288505","2023-12-22","15:12:01",""
"4079004","17.7299","0.0008","26.2321","0.0011","30.9424","0.0014","90","","90","","90","","14391.1","1.1","120","2","120","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C68 H101.1 B2 F8 N6 Ni O4 P4 -","- C68 H101.1 B2 F8 N6 Ni O4 P4 -","- C544 H808.8 B16 F64 N48 Ni8 O32 P32 -","8","1","","Lense, Sheri; Ho, Ming-Hsun; Chen, Shentan; Jain, Avijita; Raugei, Simone; Linehan, John C.; Roberts, John A. S.; Appel, Aaron M.; Shaw, Wendy","Incorporating Amino Acid Esters into Catalysts for Hydrogen Oxidation: Steric and Electronic Effects and the Role of Water as a Base","Organometallics","2012","31","19","6719","6731","10.1021/om300409y","","","0.71073","MoKα","","0.1574","0.0579","","","0.0893","0.1149","","","","","","1.005","","","","has coordinates,has disorder","288505","2023-12-22","15:12:01",""
"4079005","11.698","0.004","14.929","0.004","16.192","0.005","90.757","0.005","95.818","0.005","90.723","0.005","2812.7","1.5","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H46 Fe -","- C34 H46 Fe -","- C136 H184 Fe4 -","4","2","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0981","0.0602","","","0.1271","0.1416","","","","","","1.069","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079006","17.211","0.006","9.857","0.003","15.771","0.005","90","","116.604","0.003","90","","2392.3","1.3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H38 Fe -","- C30 H38 Fe -","- C120 H152 Fe4 -","4","1","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0745","0.0569","","","0.1567","0.1733","","","","","","1.072","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079007","36.409","0.004","9.3825","0.001","36.305","0.004","90","","90.521","0.001","90","","12402","2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H46 O2 Zr -","- C36 H46 O2 Zr -","- C576 H736 O32 Zr16 -","16","2","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0625","0.0396","","","0.0772","0.0851","","","","","","1.031","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079008","9.292","0.003","14.641","0.005","21.513","0.007","87.065","0.004","82.945","0.004","82.855","0.004","2880.1","1.6","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H46 Zr -","- C34 H46 Zr -","- C136 H184 Zr4 -","4","2","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0652","0.0408","","","0.0909","0.1013","","","","","","1.01","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079009","16.7686","0.0013","9.3871","0.0007","40.076","0.003","90","","90","","90","","6308.3","0.8","150","2","150","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C38 H54 Zr -","- C38 H54 Zr -","- C304 H432 Zr8 -","8","2","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0427","0.0344","","","0.0882","0.0916","","","","","","1.015","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079010","22.83","0.02","9.546","0.009","31.22","0.03","90","","96.965","0.01","90","","6754","11","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C77 H104 O4 Zr2 -","- C77 H104 O4 Zr2 -","- C308 H416 O16 Zr8 -","4","0.5","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0798","0.0493","","","0.1155","0.1295","","","","","","1.041","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079011","9.2216","0.0012","9.368","0.0012","18.482","0.002","96.771","0.001","98.066","0.001","109.544","0.001","1466.3","0.3","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H48 Zr -","- C34 H48 Zr -","- C68 H96 Zr2 -","2","1","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0554","0.0395","","","0.0765","0.0817","","","","","","1.035","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079012","9.6616","0.0007","19.111","0.0015","16.1409","0.0013","90","","99.61","0.001","90","","2938.5","0.4","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H48 Zr -","- C34 H48 Zr -","- C136 H192 Zr4 -","4","1","","McGovern, Gregory P.; Hung-Low, Fernando; Tye, Jesse W.; Bradley, Christopher A.","Synthesis and Reactivity Studies of Benzo-Substituted Bis(indenyl) Iron and Zirconium Complexes: The Difference a Methyl Group Can Make","Organometallics","2012","31","10","3865","","10.1021/om2011563","","","0.71073","MoKα","","0.0314","0.0254","","","0.0621","0.0658","","","","","","1.06","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079013","11.6295","0.0011","12.8313","0.0007","16.4147","0.0012","75.22","0.007","88.127","0.008","79.826","0.007","2330.9","0.3","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C66 H140 Cl2 Li2 N6 O4 Si8 Y2 -","- C66 H140 Cl2 Li2 N6 O4 Si8 Y2 -","- C66 H140 Cl2 Li2 N6 O4 Si8 Y2 -","1","0.5","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0875","0.0618","","","0.1326","0.1449","","","","","","1.068","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079014","16.669","0.003","12.1728","0.0019","25.639","0.004","90","","99.955","0.003","90","","5124","1.5","223","2","223","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H156 Cl2 Er2 Li2 N6 O4 Si8 -","- C80 H140 Cl2 Er2 Li2 N6 O4 Si8 -","- C160 H280 Cl4 Er4 Li4 N12 O8 Si16 -","2","0.5","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0695","0.0589","","","0.1308","0.1368","","","","","","1.095","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079015","16.779","0.003","12.1559","0.0019","25.691","0.004","90","","99.65","0.003","90","","5165.9","1.5","223","2","223","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H156 Cl2 Eu2 Li2 N6 O4 Si8 -","- C80 H140 Cl2 Eu2 Li2 N6 O4 Si8 -","- C160 H280 Cl4 Eu4 Li4 N12 O8 Si16 -","2","0.5","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.1148","0.0859","","","0.1418","0.1539","","","","","","1.168","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079016","16.8041","0.001","12.1432","0.0007","25.6713","0.0016","90","","99.651","0.002","90","","5164.2","0.5","223","2","223","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H156 Cl2 Li2 N6 O4 Si8 Sm2 -","- C80 H140 Cl2 Li2 N6 O4 Si8 Sm2 -","- C160 H280 Cl4 Li4 N12 O8 Si16 Sm4 -","2","0.5","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0568","0.0481","","","0.1065","0.1129","","","","","","1.135","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079017","14.9649","0.0015","28.896","0.003","11.8985","0.0012","90","","110.514","0.002","90","","4818.9","0.9","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H78 N3 O3 Si2 Y -","- C44 H78 N3 O3 Si2 Y -","- C176 H312 N12 O12 Si8 Y4 -","4","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.1069","0.0766","","","0.1536","0.1694","","","","","","1.098","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079018","15.1517","0.0018","28.82","0.004","11.9193","0.0015","90","","110.833","0.004","90","","4864.5","1.1","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H78 N3 O3 Si2 Sm -","- C44 H78 N3 O3 Si2 Sm -","- C176 H312 N12 O12 Si8 Sm4 -","4","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0837","0.0686","","","0.1312","0.1383","","","","","","1.164","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079019","12.045","0.0019","14.6328","0.0015","15.158","0.002","67.361","0.015","79.056","0.017","68.957","0.014","2297.2","0.6","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H152 N6 O2 Si8 Y2 -","- C70 H124 N6 O2 Si8 Y2 -","- C70 H124 N6 O2 Si8 Y2 -","1","0.5","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.1074","0.078","","","0.2028","0.2201","","","","","","0.998","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079020","15.2427","0.0012","28.788","0.0019","11.9569","0.001","90","","111.109","0.002","90","","4894.7","0.7","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H78 N3 Nd O3 Si2 -","- C44 H77.8 N3 Nd O3 Si2 -","- C176 H311.2 N12 Nd4 O12 Si8 -","4","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0842","0.0641","","","0.1217","0.1305","","","","","","1.154","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079021","15.2615","0.0011","14.3842","0.0011","21.9011","0.0015","90","","95.566","0.002","90","","4785.2","0.6","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H74 N3 O3 Si2 Yb -","- C42 H74 N3 O3 Si2 Yb -","- C168 H296 N12 O12 Si8 Yb4 -","4","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.0568","0.0504","","","0.1049","0.1082","","","","","","1.14","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079022","15.3128","0.0014","14.4084","0.0012","21.982","0.002","90","","95.892","0.003","90","","4824.3","0.7","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H74 N3 O3 Si2 Y -","- C42 H74 N3 O3 Si2 Y -","- C168 H296 N12 O12 Si8 Y4 -","4","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.1246","0.0918","","","0.2081","0.2298","","","","","","1.099","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079023","22.5843","0.001","15.7763","0.0007","27.2441","0.0013","90","","90","","90","","9707","0.8","223","2","223","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C44 H78 N3 Nd O3.5 Si2 -","- C44 H74 N3 Nd O3.5 Si2 -","- C352 H592 N24 Nd8 O28 Si16 -","8","1","","Li, Wenyi; Zhang, Zhongjian; Yao, Yingming; Zhang, Yong; Shen, Qi","Control of Conformations of Piperazidine-Bridged Bis(phenolato) Groups: Syntheses and Structures of Bimetallic and Monometallic Lanthanide Amides and Their Application in the Polymerization of Lactides","Organometallics","2012","31","9","3499","","10.1021/om201164t","","","0.71075","MoKα","","0.1035","0.0901","","","0.1844","0.1916","","","","","","1.258","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079024","12.412","0.005","15.159","0.005","18.483","0.005","90","0","93.559","0.005","90","0","3471","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H52 N2 Ti3 -","- C42 H52 N2 Ti3 -","- C168 H208 N8 Ti12 -","4","1","","Semproni, Scott P.; Milsmann, Carsten; Chirik, Paul J.","Side-on Dinitrogen Complexes of Titanocenes with Disubstituted Cyclopentadienyl Ligands: Synthesis, Structure, and Spectroscopic Characterization","Organometallics","2012","31","9","3672","","10.1021/om300156z","","","0.71073","MoKα","","0.0706","0.044","","","0.0955","0.1069","","","","","","1.033","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079025","13.3103","0.0004","12.5477","0.0004","16.1143","0.0005","90","","100.141","0.001","90","","2649.26","0.14","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H36 Ti2 -","- C28 H36 Ti2 -","- C112 H144 Ti8 -","4","1","","Semproni, Scott P.; Milsmann, Carsten; Chirik, Paul J.","Side-on Dinitrogen Complexes of Titanocenes with Disubstituted Cyclopentadienyl Ligands: Synthesis, Structure, and Spectroscopic Characterization","Organometallics","2012","31","9","3672","","10.1021/om300156z","","","1.54178","CuKα","","0.0281","0.0274","","","0.0719","0.0724","","","","","","1.036","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079026","20.7481","0.0004","9.7643","0.0002","16.3729","0.0003","90","","92.491","0.001","90","","3313.86","0.11","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H52 I0.04 N1.96 Ti2 -","- C36 H52 I0.0428 N1.9572 Ti2 -","- C144 H208 I0.1712 N7.8288 Ti8 -","4","0.5","","Semproni, Scott P.; Milsmann, Carsten; Chirik, Paul J.","Side-on Dinitrogen Complexes of Titanocenes with Disubstituted Cyclopentadienyl Ligands: Synthesis, Structure, and Spectroscopic Characterization","Organometallics","2012","31","9","3672","","10.1021/om300156z","","","1.54178","CuKα","","0.0474","0.047","","","0.1199","0.1201","","","","","","1.142","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079027","12.247","0.005","16.134","0.005","21.079","0.005","100.708","0.005","91.44","0.005","92.571","0.005","4086","2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H68 N2 Ti2 -","- C44 H68 N2 Ti2 -","- C176 H272 N8 Ti8 -","4","2","","Semproni, Scott P.; Milsmann, Carsten; Chirik, Paul J.","Side-on Dinitrogen Complexes of Titanocenes with Disubstituted Cyclopentadienyl Ligands: Synthesis, Structure, and Spectroscopic Characterization","Organometallics","2012","31","9","3672","","10.1021/om300156z","","","1.54184","CuKα","","0.105","0.0712","","","0.1803","0.2029","","","","","","1.034","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079028","11.073","0.005","31.309","0.005","12.392","0.005","90","","96.143","0.005","90","","4271","3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H62 B O Ti -","- C49.996 H61.996 B O Ti -","- C199.984 H247.984 B4 O4 Ti4 -","4","1","","Semproni, Scott P.; Milsmann, Carsten; Chirik, Paul J.","Side-on Dinitrogen Complexes of Titanocenes with Disubstituted Cyclopentadienyl Ligands: Synthesis, Structure, and Spectroscopic Characterization","Organometallics","2012","31","9","3672","","10.1021/om300156z","","","1.54184","CuKα","","0.0509","0.0467","","","0.113","0.1166","","","","","","0.972","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079029","15.8985","0.0006","16.4376","0.0007","27.0644","0.0011","90","","90","","90","","7072.8","0.5","123","2","123","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C27 H60 Al2 Nd O4 P Si -","- C27 H60 Al2 Nd O4 P Si -","- C216 H480 Al16 Nd8 O32 P8 Si8 -","8","1","","Roux, Erwan Le; Liang, Yucang; Törnroos, Karl W.; Nief, François; Anwander, Reiner","Heterogenization of Lanthanum and Neodymium Monophosphacyclopentadienyl Bis(tetramethylaluminate) Complexes onto Periodic Mesoporous Silica SBA-15","Organometallics","2012","31","18","6526","","10.1021/om300168s","","","0.71073","MoKα","","0.0456","0.0327","","","0.0797","0.086","","","","","","1.075","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079030","14.36","0.002","14.585","0.002","9.2908","0.0014","90","","90","","90","","1945.9","0.5","103","2","103","2","","","","","","","","5","P n n 2","P 2 -2n","34","","","","- C28 H66 Al2 O8 Si2 -","- C28 H66 Al2 O8 Si2 -","- C56 H132 Al4 O16 Si4 -","2","0.5","","Roux, Erwan Le; Liang, Yucang; Törnroos, Karl W.; Nief, François; Anwander, Reiner","Heterogenization of Lanthanum and Neodymium Monophosphacyclopentadienyl Bis(tetramethylaluminate) Complexes onto Periodic Mesoporous Silica SBA-15","Organometallics","2012","31","18","6526","","10.1021/om300168s","","","0.71073","MoKα","","0.0576","0.0571","","","0.1802","0.1813","","","","","","1.062","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079031","10.874","0.002","15.942","0.003","19.558","0.004","90","","98.592","0.007","90","","3352.4","1.1","173","","173","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C28 H38 Au F3 N2 O -","- C32 H42 Au F3 N2 O2 -","- C128 H168 Au4 F12 N8 O8 -","4","2","","Zhang, Cheng-Pan; Vicic, David A.","Oxygen-Bound Trifluoromethoxide Complexes of Copper and Gold","Organometallics","2012","31","22","7812","","10.1021/om3002747","","","0.71075","MoKα","","","0.0319","","","","0.0726","","","","","","1.06","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079032","23.948","0.006","8.3943","0.0019","20.504","0.004","90","","90","","90","","4121.9","1.6","273","","273","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C9 H12 Cu F3 N4 O -","- C9 H12 Cu F3 N4 O -","- C108 H144 Cu12 F36 N48 O12 -","12","3","","Zhang, Cheng-Pan; Vicic, David A.","Oxygen-Bound Trifluoromethoxide Complexes of Copper and Gold","Organometallics","2012","31","22","7812","","10.1021/om3002747","","","0.71075","MoKα","","","0.1291","","","","0.3851","","","","","","1","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079033","10.783","0.003","15.794","0.004","19.398","0.005","90","","98.494","0.007","90","","3267.4","1.5","173","","173","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C32 H46 Cu F3 N2 O2 -","- C32 H42 Cu F3 N2 O2 -","- C128 H168 Cu4 F12 N8 O8 -","4","2","","Zhang, Cheng-Pan; Vicic, David A.","Oxygen-Bound Trifluoromethoxide Complexes of Copper and Gold","Organometallics","2012","31","22","7812","","10.1021/om3002747","","","0.71075","MoKα","","","0.0686","","","","0.1145","","","","","","0.969","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079034","14.233","0.002","14.233","0.002","40.08","0.04","90","","90","","120","","7032","7","293","2","293","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C30 H48 Cl7 Cu4 N3 -","- C30 H48 Cl7 Cu4 N3 -","- C180 H288 Cl42 Cu24 N18 -","6","0.333333","","Ye, Qiong; Liu, Ming-Liang; Chen, Zi-Qi; Sun, Su-Wen; Xiong, Ren-Gen","Solvothermal Syntheses and Physical Properties of Noncentrosymmetric Olefin‒Copper(I) Coordination Compounds","Organometallics","2012","31","22","7862","","10.1021/om300343j","","","0.71073","MoKα","","0.0776","0.0707","","","0.1965","0.2032","","","","","","1.121","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079035","12.125","0.0009","12.125","0.0009","29.3362","0.0017","90","","90","","120","","3735.1","0.4","293","2","293","2","","","","","","","","6","R 3 :H","R 3","146","","","","- C30 H50 Br11 Cu8 N3 O -","- C30 H49.98 Br11 Cu8 N3 O -","- C90 H149.94 Br33 Cu24 N9 O3 -","3","0.333333","","Ye, Qiong; Liu, Ming-Liang; Chen, Zi-Qi; Sun, Su-Wen; Xiong, Ren-Gen","Solvothermal Syntheses and Physical Properties of Noncentrosymmetric Olefin‒Copper(I) Coordination Compounds","Organometallics","2012","31","22","7862","","10.1021/om300343j","","","0.71073","MoKα","","0.0618","0.0506","","","0.1172","0.1243","","","","","","1.012","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079036","13.5364","0.0006","8.2974","0.0004","22.0239","0.001","90","","105.239","0.002","90","","2386.68","0.19","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 K P2 S2 -","- C25 H21 K P2 S2 -","- C100 H84 K4 P8 S8 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.1087","0.098","","","0.3022","0.3154","","","","","","1.194","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079037","15.848","0.0012","11.6578","0.0009","17.3963","0.0011","90","","90","","90","","3214","0.4","173","2","173","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C31 H39 K O3 P2 S2 -","- C31 H39 K O3 P2 S2 -","- C124 H156 K4 O12 P8 S8 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.0732","0.0636","","","0.1678","0.1903","","","","","","1.145","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079038","12.373","0.0006","9.0666","0.0004","16.4623","0.0007","90","","101.19","0.002","90","","1811.65","0.14","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 P2 S2 -","- C19 H16 P2 S2 -","- C76 H64 P8 S8 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.0473","0.0357","","","0.0826","0.0935","","","","","","1.039","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079039","11.2215","0.0002","16.6052","0.0004","23.0812","0.0005","90","","90","","90","","4300.84","0.16","103","2","103","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C40 H32 Cl4 P4 S4 Sn2 -","- C40 H32 Cl4 P4 S4 Sn2 -","- C160 H128 Cl16 P16 S16 Sn8 -","4","0.5","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.0293","0.0221","","","0.0478","0.052","","","","","","1.033","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079040","18.1509","0.0006","14.6816","0.0005","20.8826","0.0007","90","","111.156","0.001","90","","5189.8","0.3","103","2","103","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H34 Al Cl9 P4 S4 Sn2 -","- C41 H34 Al Cl9 P4 S4 Sn2 -","- C164 H136 Al4 Cl36 P16 S16 Sn8 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.0707","0.0488","","","0.1298","0.1545","","","","","","1.133","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079041","8.603","0.0004","16.4257","0.0007","16.4348","0.0007","90","","96.09","0.002","90","","2309.3","0.18","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 Al Cl3 P2 S2 Sn -","- C19 H14 Al Cl3 P2 S2 Sn -","- C76 H56 Al4 Cl12 P8 S8 Sn4 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.061","0.0402","","","0.0993","0.1192","","","","","","1.093","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079042","18.1789","0.0005","13.8515","0.0004","16.517","0.0005","90","","104.333","0.002","90","","4029.6","0.2","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40.06 H34.12 Al2 Cl0.12 P4 S4 -","- C40.06 H34.12 Al2 Cl0.12 P4 S4 -","- C160.24 H136.48 Al8 Cl0.48 P16 S16 -","4","1","","Yang, Yi-Fan; Foo, Cechao; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Synthesis of a Tin(II) 1,3-Benzobis(thiophosphinoyl)methanediide Complex and Its Reactions with Aluminum Compounds","Organometallics","2012","31","18","6538","","10.1021/om300345u","","","0.71073","MoKα","","0.0631","0.038","","","0.0855","0.099","","","","","","1.031","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079043","10.8082","0.0008","11.1196","0.001","15.3516","0.0011","68.59","0.003","73.761","0.002","61.346","0.002","1494.9","0.2","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H51 Co Ru2 -","- C31 H51 Co Ru2 -","- C62 H102 Co2 Ru4 -","2","1","","Nagaoka, Masahiro; Takao, Toshiro; Suzuki, Hiroharu","Synthesis of a Heterometallic Trinuclear Cluster Containing Ruthenium and Cobalt and Its Reactivity with Internal Alkynes","Organometallics","2012","31","18","6547","","10.1021/om300371g","","","0.71069","MoKα","","0.0916","0.047","","","0.0865","0.1146","","","","","","1.089","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079044","17.3373","0.0006","17.9205","0.0006","11.4374","0.0005","90","","102.892","0.0013","90","","3463.9","0.2","153","2","153","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C39 H55 Co Ru2 -","- C39 H38 Co Ru2 -","- C156 H152 Co4 Ru8 -","4","0.5","","Nagaoka, Masahiro; Takao, Toshiro; Suzuki, Hiroharu","Synthesis of a Heterometallic Trinuclear Cluster Containing Ruthenium and Cobalt and Its Reactivity with Internal Alkynes","Organometallics","2012","31","18","6547","","10.1021/om300371g","","","0.71069","MoKα","","0.0393","0.0346","","","0.0942","0.0984","","","","","","0.911","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079045","9.218","0.001","22.874","0.001","16.629","0.001","90","","108.854","0.004","90","","3318.1","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H47 O P Pd Si4 -","- C27 H47 O P Pd Si4 -","- C108 H188 O4 P4 Pd4 Si16 -","4","1","","Ortiz, Daniel; Blug, Matthias; Le Goff, Xavier-Frédéric; Le Floch, Pascal; Mézailles, Nicolas; Maître, Philippe","Mechanistic Investigation of the Generation of a Palladium(0) Catalyst from a Palladium(II) Allyl Complex: A Combined Experimental and DFT Study","Organometallics","2012","31","17","5975","","10.1021/om300375b","","","0.71069","MoKα","","0.049","0.0308","","","0.0726","0.0777","","","","","","1.031","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079046","10.283","0.0002","10.872","0.0003","39.605","0.0009","90","","94.876","0.0011","90","","4411.69","0.18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C52 H42 O4 P2 Pd2 -","- C52 H42 O4 P2 Pd2 -","- C208 H168 O16 P8 Pd8 -","4","1","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.0817","0.0457","","","0.1058","0.1264","","","","","","1.056","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079047","10.552","0.002","12.401","0.003","18.432","0.004","86.65","0.03","84.42","0.03","70.6","0.03","2263.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H46 O4 P2 Pd2 -","- C54 H46 O4 P2 Pd2 -","- C108 H92 O8 P4 Pd4 -","2","1","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.0895","0.0503","","","0.1182","0.1467","","","","","","1.045","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079048","16.82","0.0006","26.049","0.0007","10.766","0.0004","90","","91.002","0.002","90","","4716.3","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H56 O4 P2 Pd2 -","- C52 H56 O4 P2 Pd2 -","- C208 H224 O16 P8 Pd8 -","4","0.5","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.0707","0.0446","","","0.1157","0.1355","","","","","","1.043","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079049","12.7","0.0002","13.667","0.0002","13.797","0.0003","87.295","0.0012","81.337","0.0011","70.828","0.0012","2236.12","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H30 F12 O4 P2 Pd2 -","- C46 H30 F12 O4 P2 Pd2 -","- C92 H60 F24 O8 P4 Pd4 -","2","1","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.0624","0.0427","","","0.0987","0.1139","","","","","","1.064","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079050","10.814","0.0003","12.904","0.0003","19.609","0.0005","86.872","0.0018","89.193","0.0017","77.198","0.0014","2664.31","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H66 O4 P2 Pd2 -","- C58 H66 O4 P2 Pd2 -","- C116 H132 O8 P4 Pd4 -","2","1","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.1099","0.0547","","","0.0902","0.1108","","","","","","1.084","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079051","11.91","0.0003","12.939","0.0003","18.614","0.0004","107.128","0.0015","101.874","0.0014","95.847","0.0015","2641.81","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H34 Cl6 F12 O4 P2 Pd2 -","- C48 H34 Cl6 F12 O4 P2 Pd2 -","- C96 H68 Cl12 F24 O8 P4 Pd4 -","2","1","","Ibáñez, Susana; Estevan, Francisco; Hirva, Pipsa; Sanaú, Mercedes; Úbeda, M Angeles","Dinuclear Palladium(II) and -(III) Compounds with O,O-Chelating Ligands. Room-Temperature Direct 2-Phenylation of 1-Methylindole","Organometallics","2012","31","23","8098","","10.1021/om300400k","","","0.71073","MoKα","","0.1027","0.0581","","","0.1473","0.1711","","","","","","1.028","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079052","14.0202","0.0007","12.8943","0.0007","20.3938","0.001","90","","102.288","0.001","90","","3602.3","0.3","296","2","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H46 Cl2 N2 O Si2 U -","- C28 H46 Cl2 N2 O Si2 U -","- C112 H184 Cl8 N8 O4 Si8 U4 -","4","1","","Hayes, Cassandra E.; Platel, Rachel H.; Schafer, Laurel L.; Leznoff, Daniel B.","Diamido-Ether Actinide Complexes as Catalysts for the Intramolecular Hydroamination of Aminoalkenes","Organometallics","2012","31","19","6732","","10.1021/om300410h","","","0.71073","MoKα","","0.0759","0.0524","","0.0828","0.0789","0.0783","","","","","","2.3686","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079053","8.0499","0.001","16.871","0.002","26.702","0.003","90","","90","","90","","3626.4","0.7","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H52 Cl2 N2 O3 Th -","- C32 H52 Cl2 N2 O3 Th -","- C128 H208 Cl8 N8 O12 Th4 -","4","1","","Hayes, Cassandra E.; Platel, Rachel H.; Schafer, Laurel L.; Leznoff, Daniel B.","Diamido-Ether Actinide Complexes as Catalysts for the Intramolecular Hydroamination of Aminoalkenes","Organometallics","2012","31","19","6732","","10.1021/om300410h","","","0.71073","MoKα","","0.0305","0.0244","","0.0245","0.0235","0.0233","","","","","","0.9903","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079054","11.5075","0.0004","20.0888","0.0006","35.4127","0.0012","90","","90","","90","","8186.4","0.5","293","","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H64 N2 O Si2 Th -","- C36 H64 N2 O Si2 Th -","- C288 H512 N16 O8 Si16 Th8 -","8","1","","Hayes, Cassandra E.; Platel, Rachel H.; Schafer, Laurel L.; Leznoff, Daniel B.","Diamido-Ether Actinide Complexes as Catalysts for the Intramolecular Hydroamination of Aminoalkenes","Organometallics","2012","31","19","6732","","10.1021/om300410h","","","0.71073","MoKα","","0.0899","0.045","","0.05","0.0424","0.0441","","","","","","1.5847","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079055","14.9723","0.0004","14.9723","0.0004","15.2555","0.0009","90","","90","","90","","3419.8","0.2","100","1","100","1","","","","","","","see text","4","P -4 21 c","P -4 2n","114","","","","- C19 H26 Br Ta -","- C19 H26 Br Ta -","- C152 H208 Br8 Ta8 -","8","1","","Otten, Edwin; Meetsma, Auke; Hessen, Bart","ansa-Cyclopentadienyl-Arene Tantalum Complexes: Structure and Reactivity of Neutral, Cationic, and Dicationic Derivatives","Organometallics","2012","31","17","6071","","10.1021/om300421m","","","0.71073","MoKα","","0.0385","0.0307","","","0.0662","0.0693","","","","","","1.042","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079056","20.626","0.003","14.384","0.002","24.493","0.004","90","","104.323","0.002","90","","7040.8","1.8","100","1","100","1","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H43 B2 F40 O3 Ta -","- C76 H43 B2 F40 O3 Ta -","- C304 H172 B8 F160 O12 Ta4 -","4","1","","Otten, Edwin; Meetsma, Auke; Hessen, Bart","ansa-Cyclopentadienyl-Arene Tantalum Complexes: Structure and Reactivity of Neutral, Cationic, and Dicationic Derivatives","Organometallics","2012","31","17","6071","","10.1021/om300421m","","","0.71073","MoKα","","0.083","0.0471","","","0.0904","0.1029","","","","","","0.963","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079057","10.801","0.005","14.004","0.007","26.883","0.014","90","","97.749","0.008","90","","4029","3","100","1","100","1","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H28 B F20 Ta -","- C45 H28 B F20 Ta -","- C180 H112 B4 F80 Ta4 -","4","1","","Otten, Edwin; Meetsma, Auke; Hessen, Bart","ansa-Cyclopentadienyl-Arene Tantalum Complexes: Structure and Reactivity of Neutral, Cationic, and Dicationic Derivatives","Organometallics","2012","31","17","6071","","10.1021/om300421m","","","0.71073","MoKα","","0.1254","0.0678","","","0.1465","0.1732","","","","","","0.924","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079058","12.5652","0.0007","8.0607","0.0004","16.2176","0.0009","90","","112.459","0.001","90","","1518","0.14","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H24 B9 Rh -","- C9 H24 B9 Rh -","- C36 H96 B36 Rh4 -","4","1","","Galkin, Konstantin I.; Lubimov, Sergey E.; Godovikov, Ivan A.; Dolgushin, Fedor M.; Smol’yakov, Alexander F.; Sergeeva, Elena A.; Davankov, Vadim A.; Chizhevsky, Igor T.","New Acyclic (π-Allyl)-closo-rhodacarboranes with an Agostic CH3···Rh Bonding Interaction That Operate as Unmodified Rhodium-Based Catalysts for Alkene Hydroformylation","Organometallics","2012","31","17","6080","","10.1021/om300432j","","","0.71073","MoKα","","0.0396","0.0325","","","0.0749","0.0785","","","","","","1.009","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079059","7.4499","0.0003","15.1491","0.0007","13.8738","0.0007","90","","90.677","0.001","90","","1565.68","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H26 B9 Rh -","- C10 H26 B9 Rh -","- C40 H104 B36 Rh4 -","4","1","","Galkin, Konstantin I.; Lubimov, Sergey E.; Godovikov, Ivan A.; Dolgushin, Fedor M.; Smol’yakov, Alexander F.; Sergeeva, Elena A.; Davankov, Vadim A.; Chizhevsky, Igor T.","New Acyclic (π-Allyl)-closo-rhodacarboranes with an Agostic CH3···Rh Bonding Interaction That Operate as Unmodified Rhodium-Based Catalysts for Alkene Hydroformylation","Organometallics","2012","31","17","6080","","10.1021/om300432j","","","0.71073","MoKα","","0.0315","0.0249","","","0.0555","0.058","","","","","","1.035","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079060","9.842","0.005","13.605","0.006","16.718","0.008","90","","94.849","0.016","90","","2230.5","1.8","230","2","230","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H37 Cl N3 O2 Ta -","- C16 H37 Cl N3 O2 Ta -","- C64 H148 Cl4 N12 O8 Ta4 -","4","1","","Park, Bo Keun; Kim, Hyo-Suk; Shin, Su Jung; Min, Jae Ki; Lee, Kang Mun; Do, Youngkyu; Kim, Chang Gyoun; Chung, Taek-Mo","Synthesis and Characterization of Novel Volatile Imido-Aminoalkoxide Tantalum Compounds","Organometallics","2012","31","23","8109","","10.1021/om300436p","","","0.71073","MoKα","","0.1188","0.0715","","","0.1782","0.2133","","","","","","1.019","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079061","20.2731","0.0012","14.3171","0.0007","25.7675","0.0014","90","","107.057","0.004","90","","7150.1","0.7","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C63 H100 B11 Cl2 N O4 P2 Pd Sn -","- C63 H100 B11 Cl2 N O4 P2 Pd Sn -","- C252 H400 B44 Cl8 N4 O16 P8 Pd4 Sn4 -","4","1","","Dimmer, Jörg-Alexander; Hornung, Martin; Wütz, Tobias; Wesemann, Lars","Germa- and Stanna-closo-dodecaborate in Reaction with [PdCl2(Xantphos)]: P‒C and B‒H Bond Activation","Organometallics","2012","31","20","7044","","10.1021/om300438x","","","0.71073","MoKα","","0.1269","0.09","","","0.1803","0.1967","","","","","","1.176","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079062","10.8523","0.0012","23.421","0.005","21.169","0.003","90","","90","","90","","5380.6","1.5","173","2","173","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C49 H66 B11 Cl Ge N2 O P2 Pd -","- C49 H66 B11 Cl Ge N2 O P2 Pd -","- C196 H264 B44 Cl4 Ge4 N8 O4 P8 Pd4 -","4","1","","Dimmer, Jörg-Alexander; Hornung, Martin; Wütz, Tobias; Wesemann, Lars","Germa- and Stanna-closo-dodecaborate in Reaction with [PdCl2(Xantphos)]: P‒C and B‒H Bond Activation","Organometallics","2012","31","20","7044","","10.1021/om300438x","","","0.71073","MoKα","","0.0534","0.0429","","","0.1084","0.1256","","","","","","1.239","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079063","12.4283","0.0009","12.2637","0.0006","14.8561","0.001","90","","108.995","0.005","90","","2141","0.2","173","2","173","2","","","","","","","","8","P 1 n 1","P -2yac","7","","","","- C41 H46 B11 Ge N O P2 Pd -","- C41 H46 B11 Ge N O P2 Pd -","- C82 H92 B22 Ge2 N2 O2 P4 Pd2 -","2","1","","Dimmer, Jörg-Alexander; Hornung, Martin; Wütz, Tobias; Wesemann, Lars","Germa- and Stanna-closo-dodecaborate in Reaction with [PdCl2(Xantphos)]: P‒C and B‒H Bond Activation","Organometallics","2012","31","20","7044","","10.1021/om300438x","","","0.71073","MoKα","","0.0463","0.0385","","","0.0677","0.0707","","","","","","1.137","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079064","11.5634","0.0004","19.6159","0.0006","22.5928","0.0007","90","","92.467","0.002","90","","5119.9","0.3","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C48 H61 B11 O4 P2 Pd Sn -","- C48 H61 B11 O4 P2 Pd Sn -","- C192 H244 B44 O16 P8 Pd4 Sn4 -","4","1","","Dimmer, Jörg-Alexander; Hornung, Martin; Wütz, Tobias; Wesemann, Lars","Germa- and Stanna-closo-dodecaborate in Reaction with [PdCl2(Xantphos)]: P‒C and B‒H Bond Activation","Organometallics","2012","31","20","7044","","10.1021/om300438x","","","0.71073","MoKα","","0.0381","0.0297","","","0.0683","0.0729","","","","","","1.208","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079065","15.2954","0.0006","23.7892","0.001","21.3124","0.0009","90","","91.11","0.002","90","","7753.4","0.6","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C79.5 H86.5 B11 N2.5 O4.5 P4 Pd2 Sn -","- C79.5 H86.5 B11 N2.5 O4.5 P4 Pd2 Sn -","- C318 H346 B44 N10 O18 P16 Pd8 Sn4 -","4","1","","Dimmer, Jörg-Alexander; Hornung, Martin; Wütz, Tobias; Wesemann, Lars","Germa- and Stanna-closo-dodecaborate in Reaction with [PdCl2(Xantphos)]: P‒C and B‒H Bond Activation","Organometallics","2012","31","20","7044","","10.1021/om300438x","","","0.71073","MoKα","","0.0597","0.0337","","","0.0745","0.0842","","","","","","1.011","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079066","7.8042","0.0002","10.3403","0.0003","22.6773","0.0006","90","","90","","90","","1830.01","0.09","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 Fe N O Si -","- C20 H23 Fe N O Si -","- C80 H92 Fe4 N4 O4 Si4 -","4","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0235","0.022","","","0.0608","0.0619","","","","","","1.039","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079067","9.2195","0.0003","8.7469","0.0003","9.9413","0.0004","90","","92.336","0.001","90","","801.02","0.05","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H19 Br Fe O3 -","- C16 H19 Br Fe O3 -","- C32 H38 Br2 Fe2 O6 -","2","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.044","0.0421","","","0.1127","0.1156","","","","","","1.022","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079068","23.4373","0.0005","23.4373","0.0005","7.65","0.0001","90","","90","","120","","3639.21","0.12","223","2","223","2","","","","","","","","5","P 65","P 65","170","","","","- C19 H28 Fe O3 Si2 -","- C19 H28 Fe O3 Si2 -","- C114 H168 Fe6 O18 Si12 -","6","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0653","0.0581","","","0.1526","0.1585","","","","","","1.063","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079069","12.2088","0.0002","19.7299","0.0004","8.1404","0.0001","90","","90","","90","","1960.85","0.06","223","2","223","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C17 H26 Fe O2 Si2 -","- C17 H26 Fe O2 Si2 -","- C68 H104 Fe4 O8 Si8 -","4","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0494","0.0423","","","0.0884","0.0947","","","","","","1.079","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079070","8.3549","0.0002","10.0008","0.0002","28.5722","0.0007","90","","90","","90","","2387.37","0.09","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H31 Fe N O Si2 -","- C23 H31 Fe N O Si2 -","- C92 H124 Fe4 N4 O4 Si8 -","4","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0426","0.0391","","","0.0855","0.0882","","","","","","1.047","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079071","10.9331","0.0002","11.0599","0.0002","21.0231","0.0003","90","","90","","90","","2542.09","0.07","223","2","223","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C23 H26 F5 Fe N O Si2 -","- C23 H26 F5 Fe N O Si2 -","- C92 H104 F20 Fe4 N4 O4 Si8 -","4","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0411","0.0375","","","0.0834","0.0865","","","","","","1.085","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079072","7.4546","0.0003","15.3671","0.0006","10.8018","0.0004","90","","92.031","0.002","90","","1236.63","0.08","223","2","223","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H37 Fe N O Si2 -","- C23 H37 Fe N O Si2 -","- C46 H74 Fe2 N2 O2 Si4 -","2","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0663","0.0643","","","0.1658","0.1688","","","","","","1.074","","","","has coordinates","287926","2023-12-01","07:54:24",""
"4079073","12.2271","0.0003","17.1048","0.0004","29.5106","0.0007","90","","90","","90","","6171.9","0.3","223","2","223","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C50 H84 Cl4 Fe2 N2 O3 Si4 Zr -","- C50 H84 Cl4 Fe2 N2 O3 Si4 Zr -","- C200 H336 Cl16 Fe8 N8 O12 Si16 Zr4 -","4","0.5","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.1103","0.103","","","0.2409","0.2463","","","","","","1.121","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079074","9.9389","0.0002","14.2081","0.0002","15.4979","0.0003","85.335","0.001","72.429","0.001","74.18","0.001","2007.37","0.06","223","2","223","2","","","","","","","","6","P 1","P 1","1","","","","- C17 H25 Br Fe O Si2 -","- C17 H25 Br Fe O Si2 -","- C68 H100 Br4 Fe4 O4 Si8 -","4","4","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0543","0.0496","","","0.1314","0.1381","","","","","","1.078","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079075","13.0779","0.0002","12.7776","0.0002","23.7983","0.0004","90","","97.604","0.001","90","","3941.82","0.11","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H54 Fe O4 Si3 -","- C38 H54 Fe O4 Si3 -","- C152 H216 Fe4 O16 Si12 -","4","2","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0769","0.064","","","0.1404","0.1534","","","","","","1.064","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079076","36.8117","0.0006","15.5129","0.0002","11.8778","0.0002","90","","90","","90","","6782.89","0.18","223","2","223","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C33 H44 Fe O2 Si3 -","- C33 H44 Fe O2 Si3 -","- C264 H352 Fe8 O16 Si24 -","8","2","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0803","0.0701","","","0.1616","0.1702","","","","","","1.116","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079077","10.0606","0.0002","12.4205","0.0002","19.4302","0.0004","90","","90","","90","","2427.95","0.08","223","2","223","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H36 Fe O3 Si2 -","- C21 H36 Fe O3 Si2 -","- C84 H144 Fe4 O12 Si8 -","4","1","","Wang, Xiaowu; Fröhlich, Roland; Daniliuc, Constantin G.; Rieger, Bernhard; Jonovic, Aleksandra; Kehr, Gerald; Erker, Gerhard","(“Ferrocene-salaldiminato”)zirconium Complexes for Ethylene Polymerization Catalysis: The Role of the Bulky Substituents","Organometallics","2012","31","19","6741","","10.1021/om3004509","","","0.71073","MoKα","","0.0668","0.0544","","","0.0985","0.1068","","","","","","1.12","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079078","27.793","0.0016","10.3539","0.0005","15.5649","0.0009","90","","91.783","0.002","90","","4476.9","0.4","133","2","133","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H39 N3 Ru2 -","- C19 H24 N3 Ru2 -","- C152 H192 N24 Ru16 -","8","1","","Namura, Kyo; Ohashi, Masato; Suzuki, Hiroharu","Synthesis and Structure of a Mixed-Ligand Dinuclear Ruthenium Trihydrido Complex Supported by Cn* and Cp* Ligands (Cn* = 1,4,7-Trimethyl-1,4,7-triazacyclononane, Cp* = η5-C5Me5): Enhancement of Reactivity toward CO2by Introduction of the Cn* Ligand","Organometallics","2012","31","17","5979","","10.1021/om3004674","","","0.71069","MoKα","","0.0698","0.059","","","0.1249","0.1296","","","","","","1.179","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079079","17.2728","0.0007","15.6204","0.0006","18.6939","0.0006","90","","106.659","0.0012","90","","4832.1","0.3","193","2","193","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C21 H39 N3 O4 Ru2 -","- C21 H27 N3 O4 Ru2 -","- C168 H216 N24 O32 Ru16 -","8","2","","Namura, Kyo; Ohashi, Masato; Suzuki, Hiroharu","Synthesis and Structure of a Mixed-Ligand Dinuclear Ruthenium Trihydrido Complex Supported by Cn* and Cp* Ligands (Cn* = 1,4,7-Trimethyl-1,4,7-triazacyclononane, Cp* = η5-C5Me5): Enhancement of Reactivity toward CO2by Introduction of the Cn* Ligand","Organometallics","2012","31","17","5979","","10.1021/om3004674","","","0.71069","MoKα","","0.0867","0.0534","","","0.1324","0.1608","","","","","","1.073","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079080","9.2993","0.0003","16.3159","0.0006","18.3887","0.0006","90","","90","","90","","2790.05","0.16","110","","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H31 Cl3 Ir N4 -","- C29 H31 Cl3 Ir N4 -","- C116 H124 Cl12 Ir4 N16 -","4","1","","Chianese, Anthony R.; Shaner, Sarah E.; Tendler, Jennifer A.; Pudalov, David M.; Shopov, Dimitar Y.; Kim, Daniel; Rogers, Scott L.; Mo, Allen","Iridium Complexes of Bulky CCC-Pincer N-Heterocyclic Carbene Ligands: Steric Control of Coordination Number and Catalytic Alkene Isomerization","Organometallics","2012","31","21","7359","","10.1021/om300468d","","x-ray","0.7107","MoKα","","0.0386","0.0333","","0.0683","0.0662","0.0683","","","","","","0.9949","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079081","14.0985","0.0002","15.259","0.0002","15.0008","0.0002","90","","97.3868","0.0015","90","","3200.32","0.08","110","","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H42 Cl Ir N4 -","- C40 H42 Cl Ir N4 -","- C160 H168 Cl4 Ir4 N16 -","4","1","","Chianese, Anthony R.; Shaner, Sarah E.; Tendler, Jennifer A.; Pudalov, David M.; Shopov, Dimitar Y.; Kim, Daniel; Rogers, Scott L.; Mo, Allen","Iridium Complexes of Bulky CCC-Pincer N-Heterocyclic Carbene Ligands: Steric Control of Coordination Number and Catalytic Alkene Isomerization","Organometallics","2012","31","21","7359","","10.1021/om300468d","","x-ray","0.7107","MoKα","","0.0357","0.0285","","0.0569","0.0547","0.0569","","","","","","1.0229","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079082","14.9067","0.0002","19.6272","0.0002","16.3925","0.0002","90","","113.001","0.0018","90","","4414.76","0.11","110","","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H51 Cl3 Ir N5 -","- C47 H51 Cl3 Ir N5 -","- C188 H204 Cl12 Ir4 N20 -","4","1","","Chianese, Anthony R.; Shaner, Sarah E.; Tendler, Jennifer A.; Pudalov, David M.; Shopov, Dimitar Y.; Kim, Daniel; Rogers, Scott L.; Mo, Allen","Iridium Complexes of Bulky CCC-Pincer N-Heterocyclic Carbene Ligands: Steric Control of Coordination Number and Catalytic Alkene Isomerization","Organometallics","2012","31","21","7359","","10.1021/om300468d","","x-ray","0.7107","MoKα","","0.0499","0.0431","","0.0563","0.0555","0.0563","","","","","","0.967","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079083","25.049","0.008","7.694","0.002","21.812","0.007","90","","95.872","0.005","90","","4182","2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H18 Cl2 N2 O2 Ru -","- C18 H18 Cl2 N2 O2 Ru -","- C144 H144 Cl16 N16 O16 Ru8 -","8","1","","Aliende, Cristina; Pérez-Manrique, Mercedes; Jalón, Félix A.; Manzano, Blanca R.; Rodr\?íguez, Ana M.; Espino, Gustavo","Arene Ruthenium Complexes as Versatile Catalysts in Water in both Transfer Hydrogenation of Ketones and Oxidation of Alcohols. Selective Deuterium Labeling ofrac-1-Phenylethanol","Organometallics","2012","31","17","6106","","10.1021/om3004702","","","0.71073","MoKα","","0.031","0.0289","","","0.074","0.0752","","","","","","1.078","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079084","10.2994","0.0019","12.021","0.002","12.158","0.002","110.088","0.003","106.73","0.003","107.296","0.003","1215.4","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H27 Cl N2 O6 Ru S -","- C25 H27 Cl N2 O6 Ru S -","- C50 H54 Cl2 N4 O12 Ru2 S2 -","2","1","","Aliende, Cristina; Pérez-Manrique, Mercedes; Jalón, Félix A.; Manzano, Blanca R.; Rodr\?íguez, Ana M.; Espino, Gustavo","Arene Ruthenium Complexes as Versatile Catalysts in Water in both Transfer Hydrogenation of Ketones and Oxidation of Alcohols. Selective Deuterium Labeling ofrac-1-Phenylethanol","Organometallics","2012","31","17","6106","","10.1021/om3004702","","","0.71073","MoKα","","0.0246","0.024","","","0.064","0.0644","","","","","","0.982","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079085","8.694","0.0003","10.172","0.0004","13.913","0.0016","94.744","0.002","90.465","0.002","112.019","0.002","1135.73","0.14","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C22 H26 B Cl F4 N2 O2 Ru -","- C22 H26 B Cl F4 N2 O2 Ru -","- C44 H52 B2 Cl2 F8 N4 O4 Ru2 -","2","1","","Aliende, Cristina; Pérez-Manrique, Mercedes; Jalón, Félix A.; Manzano, Blanca R.; Rodr\?íguez, Ana M.; Espino, Gustavo","Arene Ruthenium Complexes as Versatile Catalysts in Water in both Transfer Hydrogenation of Ketones and Oxidation of Alcohols. Selective Deuterium Labeling ofrac-1-Phenylethanol","Organometallics","2012","31","17","6106","","10.1021/om3004702","","","0.71073","MoKα","","0.0573","0.0373","","","0.0845","0.1","","","","","","0.787","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079086","8.4049","0.0017","10.63","0.002","14.887","0.003","102.336","0.003","90.605","0.003","109.219","0.003","1222.2","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C22 H26 Cl F6 N2 O2 P Ru -","- C22 H26 Cl F6 N2 O2 P Ru -","- C44 H52 Cl2 F12 N4 O4 P2 Ru2 -","2","1","","Aliende, Cristina; Pérez-Manrique, Mercedes; Jalón, Félix A.; Manzano, Blanca R.; Rodr\?íguez, Ana M.; Espino, Gustavo","Arene Ruthenium Complexes as Versatile Catalysts in Water in both Transfer Hydrogenation of Ketones and Oxidation of Alcohols. Selective Deuterium Labeling ofrac-1-Phenylethanol","Organometallics","2012","31","17","6106","","10.1021/om3004702","","","0.71073","MoKα","","0.0483","0.0395","","","0.0931","0.0958","","","","","","1.068","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079087","11.661","0.007","15.563","0.009","15.802","0.009","90","","96.611","0.011","90","","2849","3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H33 Cl N2 O5 Ru S -","- C29 H33 Cl N2 O5 Ru S -","- C116 H132 Cl4 N8 O20 Ru4 S4 -","4","1","","Aliende, Cristina; Pérez-Manrique, Mercedes; Jalón, Félix A.; Manzano, Blanca R.; Rodr\?íguez, Ana M.; Espino, Gustavo","Arene Ruthenium Complexes as Versatile Catalysts in Water in both Transfer Hydrogenation of Ketones and Oxidation of Alcohols. Selective Deuterium Labeling ofrac-1-Phenylethanol","Organometallics","2012","31","17","6106","","10.1021/om3004702","","","0.71073","MoKα","","0.075","0.0544","","","0.0983","0.1068","","","","","","0.966","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079088","15.8532","0.0003","38.7135","0.0007","17.0068","0.0003","90","","108.404","0.001","90","","9903.8","0.3","150","2","150","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","Stambuli 1864","","","- C70 H122 Cl12 F24 Ir4 O2 P6 -","- C70 H122 Cl12 F24 Ir4 O2 P6 -","- C280 H488 Cl48 F96 Ir16 O8 P24 -","4","1","","Whittemore, Sean M.; Yoder, Ryan J.; Stambuli, James P.","Site-Selective Alkyl Dehydrogenation of a Coordinated Acylphosphine Ligand","Organometallics","2012","31","17","6124","","10.1021/om300471h","","x-ray","0.71073","MoKα","","0.0671","0.0396","","","0.0848","0.0949","","","","","","1.016","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079089","8.9344","0.0001","16.237","0.0002","19.636","0.0003","90","","90","","90","","2848.55","0.06","210","2","210","2","","","","","","","synthesis as described","7","P 21 21 21","P 2ac 2ab","19","Stambuli 1841","","","- C24 H40 F3 Ir O4 P S -","- C24 H40 F3 Ir O4 P S -","- C96 H160 F12 Ir4 O16 P4 S4 -","4","1","","Whittemore, Sean M.; Yoder, Ryan J.; Stambuli, James P.","Site-Selective Alkyl Dehydrogenation of a Coordinated Acylphosphine Ligand","Organometallics","2012","31","17","6124","","10.1021/om300471h","","x-ray","0.71073","MoKα","","0.0453","0.0344","","","0.0706","0.0745","","","","","","1.036","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079090","9.82","0.001","9.82","0.001","32.53","0.008","90","","90","","120","","2716.7","0.8","173","2","173","2","","","","","","","","5","P 31 2 1","P 31 2""","152","02082","","","- C26 H58 Mn O2 Si4 -","- C26 H58 Mn O2 Si4 -","- C78 H174 Mn3 O6 Si12 -","3","0.5","","Engerer, Laura K.; Carlson, Christin N.; Hanusa, Timothy P.; Brennessel, William W.; Young, Victor G.","σ- vs π-Bonding in Manganese(II) Allyl Complexes","Organometallics","2012","31","17","6131","","10.1021/om300478v","","","0.71073","MoKα","","0.0362","0.033","","","0.0833","0.0855","","","","","","1.004","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079091","12.033","0.001","17.858","0.002","19.729","0.002","90","","90","","90","","4239.5","0.7","173","2","173","2","","","","","","","","5","P b c n","-P 2n 2ab","60","01367","","","- C30 H74 Mn N2 Si6 -","- C30 H58 Mn N2 Si6 -","- C120 H232 Mn4 N8 Si24 -","4","0.5","","Engerer, Laura K.; Carlson, Christin N.; Hanusa, Timothy P.; Brennessel, William W.; Young, Victor G.","σ- vs π-Bonding in Manganese(II) Allyl Complexes","Organometallics","2012","31","17","6131","","10.1021/om300478v","","","0.71073","MoKα","","0.0688","0.06","","","0.1628","0.1686","","","","","","0.99","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079092","12.046","0.002","10.253","0.002","44.85","0.007","90","","96.653","0.003","90","","5502","1.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","02132","","","- C36 H84 K2 Mn Si8 -","- C36 H84 K2 Mn Si8 -","- C144 H336 K8 Mn4 Si32 -","4","2","","Engerer, Laura K.; Carlson, Christin N.; Hanusa, Timothy P.; Brennessel, William W.; Young, Victor G.","σ- vs π-Bonding in Manganese(II) Allyl Complexes","Organometallics","2012","31","17","6131","","10.1021/om300478v","","","0.71073","MoKα","","0.0713","0.0641","","","0.1546","0.1595","","","","","","1.004","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079093","8.5628","0.0002","10.1417","0.0003","30.8228","0.0008","96.836","0.001","93.012","0.001","97.924","0.001","2625.81","0.12","100","2","100","2","","","","","","","","8","P -1","-P 1","2","Complex_4","","","- C28.09 H24.18 B Cl0.19 N2 P Pt S2 -","- C28.0925 H24.185 B Cl0.185 N2 P Pt S2 -","- C112.37 H96.74 B4 Cl0.74 N8 P4 Pt4 S8 -","4","2","","Zech, Alexander; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Utilizing the 8-Methoxycyclooct-4-en-1-ide Unit As a Hydrogen Atom Acceptor en Route to “Metal‒Borane Pincers”","Organometallics","2012","31","19","6753","","10.1021/om300482m","","","0.71073","MoKα","","0.04","0.0322","","","0.0586","0.0606","","","","","","1.154","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079094","8.5363","0.0002","10.1753","0.0003","30.8938","0.0009","97.17","0.001","92.959","0.002","98.336","0.001","2627.65","0.13","100","2","100","2","","","","","","","","8","P -1","-P 1","2","Complex_5","","","- C28.07 H24.07 B Cl0.14 N2 P Pd S2 -","- C28.0675 H24.0675 B Cl0.135 N2 P Pd S2 -","- C112.27 H96.27 B4 Cl0.54 N8 P4 Pd4 S8 -","4","2","","Zech, Alexander; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Utilizing the 8-Methoxycyclooct-4-en-1-ide Unit As a Hydrogen Atom Acceptor en Route to “Metal‒Borane Pincers”","Organometallics","2012","31","19","6753","","10.1021/om300482m","","","0.71073","MoKα","","0.0439","0.032","","","0.0684","0.0735","","","","","","1.029","","","","has coordinates","193999","2020-10-21","18:00:00",""
"4079095","9.5022","0.0003","10.2618","0.0004","17.2908","0.0006","97.541","0.002","102.928","0.002","109.843","0.002","1505.73","0.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Complex_6","","","- C33 H27 B N3 P Pd S3 -","- C33 H27 B N3 P Pd S3 -","- C66 H54 B2 N6 P2 Pd2 S6 -","2","1","","Zech, Alexander; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Utilizing the 8-Methoxycyclooct-4-en-1-ide Unit As a Hydrogen Atom Acceptor en Route to “Metal‒Borane Pincers”","Organometallics","2012","31","19","6753","","10.1021/om300482m","","","0.71073","MoKα","","0.0418","0.0364","","","0.0923","0.0956","","","","","","1.052","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079096","37.5195","0.0006","37.5195","0.0006","13.494","0.0002","90","","90","","120","","16450.7","0.4","160","1","160","1","","","","","","","","6","R 3 :H","R 3","146","","","","- C76 H60 N2 Ni O6 P2 -","- C68 H44 N2 Ni O4 P2 -","- C612 H396 N18 Ni9 O36 P18 -","9","1","","Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano","“Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms","Organometallics","2012","31","17","6162","","10.1021/om300484z","","","0.71073","MoKα","","0.0387","0.0359","","","0.1045","0.1059","","","","","","1.065","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079097","11.73863","0.0001","11.70932","0.00011","58.7106","0.0005","90","","92.4392","0.0009","90","","8062.54","0.12","160","1","160","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C64.67 H58 N5.33 Ni O2 P2 -","- C64.6667 H58 N5.33333 Ni O2 P2 -","- C388 H348 N32 Ni6 O12 P12 -","6","3","","Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano","“Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms","Organometallics","2012","31","17","6162","","10.1021/om300484z","","","0.71073","MoKα","","0.0626","0.0593","","","0.1186","0.1199","","","","","","1.198","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079098","12.44923","0.00018","14.1316","0.0002","32.7302","0.0005","90","","90","","90","","5758.14","0.15","160","1","160","1","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C70 H46 Cl2 N2 Ni O4 P2 S2 -","- C70 H46 Cl2 N2 Ni O4 P2 S2 -","- C280 H184 Cl8 N8 Ni4 O16 P8 S8 -","4","1","","Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano","“Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms","Organometallics","2012","31","17","6162","","10.1021/om300484z","","","0.71073","MoKα","","0.0462","0.037","","","0.0837","0.0888","","","","","","1.029","","","","has coordinates","178679","2020-10-21","18:00:00",""
"4079099","12.547","0.0003","22.4042","0.0005","25.2593","0.0006","90","","90","","90","","7100.5","0.3","160","1","160","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C87 H68 N2 Ni O5 P2 -","- C81 H62 N2 Ni O5 P2 -","- C324 H248 N8 Ni4 O20 P8 -","4","1","","Linden, Anthony; Llovera, Ligia; Herrera, Julio; Dorta, Reto; Agrifoglio, Giuseppe; Dorta, Romano","“Chiral-at-Metal” Hemilabile Nickel Complexes with a Latent d10-ML2Configuration: Receiving Substrates with Open Arms","Organometallics","2012","31","17","6162","","10.1021/om300484z","","","0.71073","MoKα","","0.072","0.0548","","","0.1407","0.1505","","","","","","1.046","","","","has coordinates,has disorder","178679","2020-10-21","18:00:00",""
"4079100","18.15205","0.00009","18.15205","0.00009","13.4812","0.00009","90","","90","","90","","4442.01","0.04","173","","173","","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C88 H120 Cu8 O16 -","- C56 H56 Cu8 O8 -","- C112 H112 Cu16 O16 -","2","0.25","","Bomparola, Roberta; Davies, Robert P.; Lal, Steven; White, Andrew J. P.","Functionalized Organocuprates: Structures of Lithium and Magnesium Grignard 2-Methoxyphenylcuprates","Organometallics","2012","31","22","7877","","10.1021/om300488j","","","1.54184","CuKα","","0.0646","0.0577","","","0.2155","0.224","","","","","","1.148","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079101","17.96778","0.00017","17.6095","0.00018","30.1255","0.0004","90","","90","","90","","9531.82","0.18","173","","173","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C50 H58 Cu4 Li2 O8 -","- C50 H58 Cu4 Li2 O8 -","- C400 H464 Cu32 Li16 O64 -","8","1","","Bomparola, Roberta; Davies, Robert P.; Lal, Steven; White, Andrew J. P.","Functionalized Organocuprates: Structures of Lithium and Magnesium Grignard 2-Methoxyphenylcuprates","Organometallics","2012","31","22","7877","","10.1021/om300488j","","","0.71073","MoKα","","0.1018","0.0563","","","0.1168","0.141","","","","","","1.131","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079102","8.18331","0.00006","8.431","0.00006","33.1182","0.0002","90","","90","","90","","2284.94","0.03","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H30 Br Cu Mg O4 -","- C22 H30 Br Cu Mg O4 -","- C88 H120 Br4 Cu4 Mg4 O16 -","4","1","","Bomparola, Roberta; Davies, Robert P.; Lal, Steven; White, Andrew J. P.","Functionalized Organocuprates: Structures of Lithium and Magnesium Grignard 2-Methoxyphenylcuprates","Organometallics","2012","31","22","7877","","10.1021/om300488j","","","1.54184","CuKα","","0.0176","0.0163","","","0.043","0.0434","","","","","","1.101","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079103","7.9461","0.0015","8.5104","0.0007","33.255","0.003","90","","90","","90","","2248.9","0.5","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H30 Cl Cu Mg O4 -","- C22 H30 Cl Cu Mg O4 -","- C88 H120 Cl4 Cu4 Mg4 O16 -","4","1","","Bomparola, Roberta; Davies, Robert P.; Lal, Steven; White, Andrew J. P.","Functionalized Organocuprates: Structures of Lithium and Magnesium Grignard 2-Methoxyphenylcuprates","Organometallics","2012","31","22","7877","","10.1021/om300488j","","","1.54184","CuKα","","0.0662","0.061","","","0.145","0.1467","","","","","","1.179","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079104","12.645","0.0004","12.665","0.0004","18.3271","0.0006","86.642","0.002","85.409","0.002","68.642","0.002","2723.35","0.16","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H75 N S Sn -","- C58 H75 N S Sn -","- C116 H150 N2 S2 Sn2 -","2","1","","Fatah, Abdoul; Ghereg, Dumitru; Escudié, Jean; Saffon, Nathalie; Ladeira, Sonia; Ranaivonjatovo, Henri","Versatile Reactivity of Stannene Tip2Sn═CR2with Unsaturated Compounds","Organometallics","2012","31","17","6148","","10.1021/om3004916","","","0.71073","MoKα","","0.0368","0.0299","","","0.0744","0.0793","","","","","","1.052","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079105","11.8989","0.0002","16.354","0.0003","17.1547","0.0003","84.596","0.001","69.897","0.001","75.728","0.001","3037.92","0.1","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C64.5 H91 N O Sn -","- C64.5 H91 N O Sn -","- C129 H182 N2 O2 Sn2 -","2","1","","Fatah, Abdoul; Ghereg, Dumitru; Escudié, Jean; Saffon, Nathalie; Ladeira, Sonia; Ranaivonjatovo, Henri","Versatile Reactivity of Stannene Tip2Sn═CR2with Unsaturated Compounds","Organometallics","2012","31","17","6148","","10.1021/om3004916","","","0.71073","MoKα","","0.0363","0.0298","","","0.0738","0.0779","","","","","","1.026","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079106","13.6754","0.0003","14.4472","0.0004","16.8577","0.0004","90.391","0.002","107.263","0.002","107.259","0.002","3020.87","0.14","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H93 N O2 Sn -","- C66 H93 N O2 Sn -","- C132 H186 N2 O4 Sn2 -","2","1","","Fatah, Abdoul; Ghereg, Dumitru; Escudié, Jean; Saffon, Nathalie; Ladeira, Sonia; Ranaivonjatovo, Henri","Versatile Reactivity of Stannene Tip2Sn═CR2with Unsaturated Compounds","Organometallics","2012","31","17","6148","","10.1021/om3004916","","","0.71073","MoKα","","0.1153","0.0585","","","0.0973","0.116","","","","","","0.977","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079107","12.084","0.002","12.8","0.002","18.053","0.005","92.266","0.009","106.636","0.008","101.778","0.005","2604.8","0.9","193","2","193","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C54 H75 Cl2 N Sn -","- C54 H75 Cl2 N Sn -","- C108 H150 Cl4 N2 Sn2 -","2","1","","Fatah, Abdoul; Ghereg, Dumitru; Escudié, Jean; Saffon, Nathalie; Ladeira, Sonia; Ranaivonjatovo, Henri","Versatile Reactivity of Stannene Tip2Sn═CR2with Unsaturated Compounds","Organometallics","2012","31","17","6148","","10.1021/om3004916","","x-ray","0.71073","MoKα","","0.0396","0.0312","","","0.0702","0.0745","","","","","","1.037","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079108","13.521","0.006","21.92","0.009","7.978","0.003","90","","103.597","0.007","90","","2298.3","1.6","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C26 H30 Cl N2 O Rh -","- C26 H30 Cl N2 O Rh -","- C104 H120 Cl4 N8 O4 Rh4 -","4","1","","Peñafiel, Itziar; Pastor, Isidro M.; Yus, Miguel; Esteruelas, Miguel A.; Oliván, Montserrat","Preparation, Hydrogen Bonds, and Catalytic Activity in Metal-Promoted Addition of Arylboronic Acids to Enones of a Rhodium Complex Containing an NHC Ligand with an Alcohol Function","Organometallics","2012","31","17","6154","","10.1021/om300498e","","","0.71073","MoKα","","0.1045","0.0564","","","0.093","0.1037","","","","","","0.856","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079109","9.4324","0.0001","19.9781","0.0003","21.2265","0.0003","90","","98.476","0.001","90","","3956.26","0.09","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H55 Cl Co N O9 P3 Ru -","- C34 H55 Cl Co N O9 P3 Ru -","- C136 H220 Cl4 Co4 N4 O36 P12 Ru4 -","4","1","","Ip, Ho-Fai; So, Yat-Ming; Sung, Herman H. Y.; Williams, Ian D.; Leung, Wa-Hung","Ruthenium-Mediated Double C‒H Activation of Toluene with 1-Azidoadamantane","Organometallics","2012","31","19","7020","","10.1021/om300499x","","","1.54178","CuKα","","0.0448","0.0395","","","0.1009","0.1028","","","","","","1.006","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079110","13.9067","0.0002","21.2398","0.0003","12.3711","0.0002","90","","90","","90","","3654.12","0.09","173","2","173","2","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C24 H41 Cl4 Co N2 O11 P3 Ru -","- C24 H41 Cl4 Co N2 O11 P3 Ru -","- C96 H164 Cl16 Co4 N8 O44 P12 Ru4 -","4","1","","Ip, Ho-Fai; So, Yat-Ming; Sung, Herman H. Y.; Williams, Ian D.; Leung, Wa-Hung","Ruthenium-Mediated Double C‒H Activation of Toluene with 1-Azidoadamantane","Organometallics","2012","31","19","7020","","10.1021/om300499x","","","1.54178","CuKα","","0.0436","0.0371","","","0.078","0.0794","","","","","","1.024","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079111","8.6834","0.0002","8.9379","0.0002","37.5356","0.0009","90","","90","","90","","2913.19","0.12","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H47 Ca I O4 -","- C27 H47 Ca I O4 -","- C108 H188 Ca4 I4 O16 -","4","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.0742","0.0421","","","0.0695","0.0765","","","","","","0.98","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079112","8.7118","0.0007","8.9636","0.0007","37.91","0.003","90","","90","","90","","2960.4","0.4","183","2","183","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 Ca Cl I O4 -","- C26 H44 Ca Cl I O4 -","- C104 H176 Ca4 Cl4 I4 O16 -","4","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.1339","0.0518","","","0.0956","0.1257","","","","","","1.012","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079113","8.8432","0.0005","8.9677","0.0005","37.2212","0.0019","90","","90","","90","","2951.8","0.3","133","2","133","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 Br Ca I O4 -","- C26 H44 Br Ca I O4 -","- C104 H176 Br4 Ca4 I4 O16 -","4","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.077","0.0643","","","0.1603","0.1657","","","","","","1.107","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079114","8.7798","0.0002","10.3531","0.0003","34.4556","0.0008","98.448","0.001","91.311","0.001","97.491","0.001","3068.7","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25.7 H43.8 Ca I2 O4 -","- C25.7 H43.8 Ca I2 O4 -","- C102.8 H175.2 Ca4 I8 O16 -","4","2","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.0536","0.0455","","","0.0941","0.0988","","","","","","1.081","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079115","9.1602","0.0002","37.6073","0.0009","8.8171","0.0002","90","","90","","90","","3037.41","0.12","183","2","183","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C27 H47 Ca I O5 -","- C27 H47 Ca I O5 -","- C108 H188 Ca4 I4 O20 -","4","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.084","0.04","","","0.0618","0.0723","","","","","","0.928","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079116","8.9143","0.0002","9.6609","0.0003","21.5944","0.0007","101.289","0.001","97.47","0.002","93.212","0.002","1801.89","0.09","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H57 Ca I O5 -","- C35 H57 Ca I O5 -","- C70 H114 Ca2 I2 O10 -","2","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.0665","0.0621","","","0.173","0.1769","","","","","","1.15","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079117","8.3611","0.0003","10.146","0.0005","17.387","0.0008","91.145","0.002","92.475","0.003","102.95","0.003","1435.45","0.11","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H47 Br Li2 O4 -","- C27 H47 Br Li2 O4 -","- C54 H94 Br2 Li4 O8 -","2","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.0346","0.03","","","0.0645","0.0677","","","","","","1.117","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079118","7.4522","0.0007","19.0831","0.0017","19.9461","0.0011","90","","94.64","0.005","90","","2827.3","0.4","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H42 Li2 O4 -","- C29 H42 Li2 O4 -","- C116 H168 Li8 O16 -","4","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.2471","0.0734","","","0.1192","0.1693","","","","","","0.947","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079119","11.1447","0.0003","12.5054","0.0003","13.563","0.0003","83.638","0.001","66.806","0.001","63.994","0.001","1557.17","0.07","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H50 Li2 O4 -","- C32 H50 Li2 O4 -","- C64 H100 Li4 O8 -","2","1","","Langer, Jens; Köhler, Mathias; Fischer, Reinald; Dündar, Feyza; Görls, Helmar; Westerhausen, Matthias","Arylcalcium Iodides in Tetrahydropyran: Solution Stability in Comparison to Aryllithium Reagents","Organometallics","2012","31","17","6172","","10.1021/om300508w","","","0.71073","MoKα","","0.0543","0.046","","","0.1","0.1069","","","","","","1.083","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079120","14.1603","0.0005","10.7021","0.0003","34.5829","0.0013","90","","90","","90","","5240.9","0.3","115","","115","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C35 H29 Fe3 N -","- C35 H29 Fe3 N -","- C280 H232 Fe24 N8 -","8","1","","Pfaff, Ulrike; Hildebrandt, Alexander; Schaarschmidt, Dieter; Hahn, Torsten; Liebing, Simon; Kortus, Jens; Lang, Heinrich","Di- and Triferrocenyl (Hetero)Aromatics: Synthesis, Characterization, (Spectro-)Electrochemistry, and Calculations","Organometallics","2012","31","19","6761","","10.1021/om300511v","","","0.71073","MoKα","","0.082","0.0489","","","0.1174","0.1249","","","","","","0.949","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079121","11.3264","0.0015","10.9998","0.0015","12.2185","0.0016","90","","112.51","0.002","90","","1406.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 Cr O3 -","- C18 H12 Cr O3 -","- C72 H48 Cr4 O12 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0415","0.0358","","","0.0926","0.0959","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079122","8.3815","0.0004","10.1729","0.0004","52.705","0.002","90","","90","","90","","4493.8","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H11 O3 Re -","- C18 H11 O3 Re -","- C216 H132 O36 Re12 -","12","3","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0487","0.0474","","","0.095","0.0955","","","","","","1.283","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079123","6.0013","0.0004","19.5708","0.0012","15.5061","0.0009","90","","98.909","0.001","90","","1799.22","0.19","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Cr O3 -","- C23 H22 Cr O3 -","- C92 H88 Cr4 O12 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0409","0.0357","","","0.0934","0.0964","","","","","","1.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079124","15.186","0.003","8.2628","0.0015","16.016","0.003","90","","111.483","0.003","90","","1870.1","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 O3 Re -","- C23 H17 O3 Re -","- C92 H68 O12 Re4 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0346","0.0287","","","0.0645","0.0667","","","","","","1.048","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079125","22.3421","0.0019","10.7303","0.0009","18.7235","0.0015","90","","116.783","0.002","90","","4007.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 Cr O3 -","- C26 H16 Cr O3 -","- C208 H128 Cr8 O24 -","8","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0508","0.0431","","","0.1124","0.1184","","","","","","1.069","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079126","13.6588","0.0014","14.8955","0.0015","11.3118","0.0011","90","","113.353","0.002","90","","2112.9","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H18 Cr O3 -","- C29 H18 Cr O3 -","- C116 H72 Cr4 O12 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0634","0.0566","","","0.1461","0.151","","","","","","1.072","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079127","7.7534","0.0007","9.9783","0.0009","12.5568","0.0012","85.996","0.002","85.794","0.002","78.929","0.002","949.28","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H15 O3 Re -","- C26 H15 O3 Re -","- C52 H30 O6 Re2 -","2","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0348","0.0294","","","0.0644","0.0664","","","","","","1.048","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079128","8.0644","0.0009","24.041","0.003","10.9718","0.0012","90","","109.801","0.003","90","","2001.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H15 O3 Re -","- C26 H15 O3 Re -","- C104 H60 O12 Re4 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0381","0.0311","","","0.0703","0.0728","","","","","","1.067","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079129","12.9308","0.0017","11.2668","0.0015","12.9929","0.0017","90","","98.19","0.004","90","","1873.6","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H16 Cr O3 -","- C26 H16 Cr O3 -","- C104 H64 Cr4 O12 -","4","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0638","0.054","","","0.1213","0.1252","","","","","","1.129","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079130","15.649","0.002","10.3162","0.0015","6.9097","0.001","90","","90","","90","","1115.5","0.3","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C13 H10 Cr O3 -","- C13 H10 Cr O3 -","- C52 H40 Cr4 O12 -","4","0.5","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0425","0.0386","","","0.1005","0.1021","","","","","","1.196","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079131","10.2673","0.0008","11.5569","0.0009","13.1236","0.001","88.489","0.001","77.448","0.001","70.282","0.001","1429.01","0.19","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C37.025 H28.855 Cl0.585 O3 Re -","- C37.024 H28.854 Cl0.582 O3 Re -","- C74.048 H57.708 Cl1.164 O6 Re2 -","2","1","","Nikitin, Kirill; Bothe, Cornelia; Müller-Bunz, Helge; Ortin, Yannick; McGlinchey, Michael J.","High and Low Rotational Barriers in Metal Tricarbonyl Complexes of 2- and 3-Indenyl Anthracenes and Triptycenes: Rational Design of Molecular Brakes","Organometallics","2012","31","17","6183","","10.1021/om300512z","","","0.71073","MoKα","","0.0274","0.0255","","","0.0634","0.0641","","","","","","1.085","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079132","15.9391","0.0001","11.7641","0.0001","26.1975","0.0002","90","","95.27","0.001","90","","4891.51","0.06","100","2","100","2","","","","","","","","7","P 1 c 1","P -2yc","7","","","","- C114 H100 As2 F12 Fe2 P4 Ru2 -","- C114 H100 As2 F12 Fe2 P4 Ru2 -","- C228 H200 As4 F24 Fe4 P8 Ru4 -","2","1","","Bruce, Michael I.; Costuas, Karine; Gendron, Frédéric; Halet, Jean-François; Jevric, Martyn; Skelton, Brian W.","Oxidative Dimerization of Aryldiynyl‒Ruthenium Complexes","Organometallics","2012","31","18","6555","","10.1021/om3005146","","","1.54178","CuKα","","0.0436","0.0338","","","0.0716","0.0746","","","","","","0.929","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079133","11.7963","0.0004","16.7726","0.0009","20.4211","0.0007","94.253","0.004","105.569","0.003","97.765","0.004","3830.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H74 F12 P6 Ru2 -","- C88 H74 F12 P6 Ru2 -","- C176 H148 F24 P12 Ru4 -","2","1","","Bruce, Michael I.; Costuas, Karine; Gendron, Frédéric; Halet, Jean-François; Jevric, Martyn; Skelton, Brian W.","Oxidative Dimerization of Aryldiynyl‒Ruthenium Complexes","Organometallics","2012","31","18","6555","","10.1021/om3005146","","","1.54178","CuKα","","0.1393","0.0799","","","0.2069","0.233","","","","","","0.959","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079134","9.2957","0.0005","16.0961","0.0006","17.2103","0.0009","106.581","0.005","105.399","0.004","104.772","0.004","2221.7","0.2","150","0.2","150","0.2","","","","","","","","8","P -1","-P 1","2","","","","- C35 H72 F3 Fe N4 O4 S Si2 -","- C35 H72 F3 Fe N4 O4 S Si2 -","- C70 H144 F6 Fe2 N8 O8 S2 Si4 -","2","1","","Cao, Zhi; Forrest, William P.; Gao, Yang; Fanwick, Phillip E.; Ren, Tong","trans-[Fe(cyclam)(C2R)2]+: A New Family of Iron(III) Bis-Alkynyl Compounds","Organometallics","2012","31","17","6199","","10.1021/om300515r","","","1.54184","CU-Kα","","0.053","0.051","","","0.14","0.143","","","","","","1.038","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4079135","9.5167","0.0006","11.8798","0.0006","12.265","0.0009","90","","90.108","0.005","90","","1386.64","0.15","150","0.2","150","0.2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H34 F3 Fe N4 O3 S -","- C27 H34 F3 Fe N4 O3 S -","- C54 H68 F6 Fe2 N8 O6 S2 -","2","0.5","","Cao, Zhi; Forrest, William P.; Gao, Yang; Fanwick, Phillip E.; Ren, Tong","trans-[Fe(cyclam)(C2R)2]+: A New Family of Iron(III) Bis-Alkynyl Compounds","Organometallics","2012","31","17","6199","","10.1021/om300515r","","","1.54184","CU-Kα","","0.079","0.076","","","0.216","0.22","","","","","","1.038","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4079136","12.09","0.0011","11.6199","0.0011","24.842","0.003","90","","90","","90","","3489.9","0.6","150","0.2","150","0.2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C25 H42 F3 Fe N4 O3 S Si2 -","- C25 H42 F3 Fe N4 O3 S Si2 -","- C100 H168 F12 Fe4 N16 O12 S4 Si8 -","4","0.5","","Cao, Zhi; Forrest, William P.; Gao, Yang; Fanwick, Phillip E.; Ren, Tong","trans-[Fe(cyclam)(C2R)2]+: A New Family of Iron(III) Bis-Alkynyl Compounds","Organometallics","2012","31","17","6199","","10.1021/om300515r","","","1.54184","CU-Kα","","0.134","0.095","","","0.252","0.292","","","","","","1.039","","","","has coordinates,has disorder","288505","2023-12-22","15:12:01",""
"4079137","14.3896","0.0002","11.5377","0.0002","16.7832","0.0003","90","","107.82","0.001","90","","2652.71","0.08","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C21 H37 Cl3 N O P Ru S -","- C21 H37 Cl3 N O P Ru S -","- C84 H148 Cl12 N4 O4 P4 Ru4 S4 -","4","1","","Gargir, Moti; Ben-David, Yehoshua; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David","PNS-Type Ruthenium Pincer Complexes","Organometallics","2012","31","17","6207","","10.1021/om300516j","","","0.71073","MoKα","","0.0552","0.0415","","","0.0841","0.0887","","","","","","1.168","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079138","9.3128","0.0019","9.4472","0.0019","12.965","0.003","85.03","0.04","72.33","0.03","83.34","0.03","1077.9","0.4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H68 N2 O2 P2 Ru2 S2 -","- C40 H68 N2 O2 P2 Ru2 S2 -","- C40 H68 N2 O2 P2 Ru2 S2 -","1","0.5","","Gargir, Moti; Ben-David, Yehoshua; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David","PNS-Type Ruthenium Pincer Complexes","Organometallics","2012","31","17","6207","","10.1021/om300516j","","","0.71073","MoKα","","0.0578","0.0425","","","0.0864","0.0925","","","","","","1.031","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079139","22.4462","0.0008","16.0164","0.0006","27.0697","0.001","90","","111.398","0.002","90","","9060.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H72 N2 O2 P2 Ru2 S2 -","- C41 H72 N2 O2 P2 Ru2 S2 -","- C328 H576 N16 O16 P16 Ru16 S16 -","8","2","","Gargir, Moti; Ben-David, Yehoshua; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David","PNS-Type Ruthenium Pincer Complexes","Organometallics","2012","31","17","6207","","10.1021/om300516j","","","0.71073","MoKα","","0.0992","0.0485","","","0.0889","0.1101","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079140","14.3105","0.0007","11.8513","0.0006","16.723","0.0006","90","","124.669","0.003","90","","2332.6","0.2","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C20.17 H35.17 Cl0.83 N O1.34 P Ru S -","- C20.17 H35.17 Cl0.83 N O1.34 P Ru S -","- C80.68 H140.68 Cl3.32 N4 O5.36 P4 Ru4 S4 -","4","1","","Gargir, Moti; Ben-David, Yehoshua; Leitus, Gregory; Diskin-Posner, Yael; Shimon, Linda J. W.; Milstein, David","PNS-Type Ruthenium Pincer Complexes","Organometallics","2012","31","17","6207","","10.1021/om300516j","","","0.71073","MoKα","","0.0345","0.0296","","","0.0674","0.0691","","","","","","1.183","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079141","42.824","0.009","10.924","0.002","19.516","0.004","90","","109.912","0.003","90","","8584","3","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H60 O Si5 -","- C45 H60 O Si5 -","- C360 H480 O8 Si40 -","8","1","","Ishida, Shintaro; Uchida, Kenya; Onodera, Tsunenobu; Oikawa, Hidetoshi; Kira, Mitsuo; Iwamoto, Takeaki","Siloxy-Substituted Cyclopentadiene Showing Aggregation-Enhanced Emission: An Application of Cycloaddition of Isolable Dialkylsilylene","Organometallics","2012","31","17","5983","","10.1021/om3005178","","","0.71073","MoKα","","0.0657","0.0561","","","0.143","0.151","","","","","","1.036","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079142","11.556","0.002","14.496","0.003","22.11","0.004","94.396","0.002","101.368","0.002","105.622","0.002","3463.8","1.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H107 O Si10 -","- C64 H107 O Si10 -","- C128 H214 O2 Si20 -","2","1","","Ishida, Shintaro; Uchida, Kenya; Onodera, Tsunenobu; Oikawa, Hidetoshi; Kira, Mitsuo; Iwamoto, Takeaki","Siloxy-Substituted Cyclopentadiene Showing Aggregation-Enhanced Emission: An Application of Cycloaddition of Isolable Dialkylsilylene","Organometallics","2012","31","17","5983","","10.1021/om3005178","","","0.71073","MoKα","","0.0618","0.0409","","","0.0948","0.1031","","","","","","0.977","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079143","11.044","0.001","12.581","0.0014","12.62","0.0009","81.165","0.008","78.221","0.007","75.831","0.012","1654.4","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","(2,6-diisopropyl-phenyl)-[(2-isopropyl-phenyl)-[6-(1H-pyrrol-2-yl)- pyridin-2-yl]-methyl]-amine-bis(dimethylamino) -Titanium(I)","","- C35 H47 N5 Ti -","- C35 H47 N5 Ti -","- C70 H94 N10 Ti2 -","2","1","","Li, Gang; Lamberti, Marina; Roviello, Giuseppina; Pellecchia, Claudio","New Titanium and Hafnium Complexes Bearing [−NNN–] Pyrrolylpyridylamido Ligands as Olefin Polymerization Catalysts","Organometallics","2012","31","19","6772","","10.1021/om300519s","","","0.71073","MoKα","","0.0627","0.0438","","","0.0992","0.1123","","","","","","1.092","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079144","35.772","0.002","13.073","0.003","14.102","0.005","90","","90","","90","","6595","3","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","(2,6-diisopropyl-phenyl)-[(2-isopropyl-phenyl)-[6-(1H-pyrrol-2-yl)- pyridin-2-yl]-methyl]-amine-bis(dimethylamino) -Hafnium","","- C35 H47 Hf N5 -","- C35 H47 Hf N5 -","- C280 H376 Hf8 N40 -","8","2","","Li, Gang; Lamberti, Marina; Roviello, Giuseppina; Pellecchia, Claudio","New Titanium and Hafnium Complexes Bearing [−NNN–] Pyrrolylpyridylamido Ligands as Olefin Polymerization Catalysts","Organometallics","2012","31","19","6772","","10.1021/om300519s","","","0.71073","MoKα","","0.0374","0.0297","","","0.0501","0.0516","","","","","","1.123","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079145","23.719","0.002","11.9157","0.0012","16.9613","0.0017","90","","107.073","0.002","90","","4582.5","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H52 Cl4 N6 Pd -","- C43 H52 Cl4 N6 Pd -","- C172 H208 Cl16 N24 Pd4 -","4","0.5","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Palladium 1,2,3-Triazol-5-ylidene Mesoionic Carbene PEPPSI Complexes and Their Catalytic Applications in the Mizoroki–Heck Reaction","Organometallics","2012","31","17","6215","","10.1021/om3005228","","","0.71073","MoKα","","0.1115","0.0744","","","0.1854","0.2206","","","","","","1.06","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079146","15.235","0.006","8.948","0.004","19.304","0.008","90","","101.053","0.005","90","","2582.8","1.9","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C46 H54 Cl4 N8 Pd2 -","- C46 H54 Cl4 N8 Pd2 -","- C92 H108 Cl8 N16 Pd4 -","2","1","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Palladium 1,2,3-Triazol-5-ylidene Mesoionic Carbene PEPPSI Complexes and Their Catalytic Applications in the Mizoroki‒Heck Reaction","Organometallics","2012","31","17","6215","","10.1021/om3005228","","","0.71073","MoKα","","0.1509","0.0663","","","0.134","0.1603","","","","","","0.859","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079147","10.5239","0.0003","15.6327","0.0004","21.1539","0.0006","109.601","0.002","98.819","0.002","100.718","0.002","3132.62","0.16","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C26.75 H31.5 Cl3.5 N4 Pd -","- C25.99 H29.97 Cl2 N4 Pd -","- C103.96 H119.88 Cl8 N16 Pd4 -","4","2","","Keske, Eric C.; Zenkina, Olena V.; Wang, Ruiyao; Crudden, Cathleen M.","Synthesis and Structure of Palladium 1,2,3-Triazol-5-ylidene Mesoionic Carbene PEPPSI Complexes and Their Catalytic Applications in the Mizoroki‒Heck Reaction","Organometallics","2012","31","17","6215","","10.1021/om3005228","","","0.71073","MoKα","","0.0765","0.0584","","","0.1585","0.1678","","","","","","1.066","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079148","23.6676","0.0013","11.3775","0.0002","17.8694","0.0017","90","","127.018","0.009","90","","3842","0.6","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H12 N3 O4 Re -","- C22 H12 N3 O4 Re -","- C176 H96 N24 O32 Re8 -","8","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","0.71073","MOKα","","0.0198","0.0184","","","0.0487","0.0497","","","","","","1.08","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079149","12.1681","0.0003","11.0649","0.0003","17.4182","0.0004","90","0.02","91.646","0.002","90","0.02","2344.2","0.1","133","","133","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H13 F6 N3 O4 P Re -","- C22 H13 F6 N3 O4 P Re -","- C88 H52 F24 N12 O16 P4 Re4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54178","CuKα","","0.0301","0.0295","","","0.0752","0.0757","","","","","","1.139","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079150","8.1807","0.0009","11.7759","0.0008","12.6684","0.0009","83.666","0.006","81.993","0.007","75.973","0.007","1168.75","0.18","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H15 F6 N3 O4 P Re -","- C23 H15 F6 N3 O4 P Re -","- C46 H30 F12 N6 O8 P2 Re2 -","2","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54184","CUKα","","0.0282","0.0279","","","0.0763","0.0766","","","","","","1.086","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079151","10.9257","0.0002","20.0094","0.0003","17.2111","0.0003","90","0.02","100.859","0.002","90","0.02","3695.26","0.11","133","2","133.1","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H32 F6 N3 O4 P2 Re -","- C37 H32 F6 N3 O4 P2 Re -","- C148 H128 F24 N12 O16 P8 Re4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.5418","CuKα","","0.0245","0.0228","","","0.0573","0.0584","","","","","","1.049","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079152","13.7655","0.0001","19.0956","0.0002","24.872","0.0003","90","0.02","101.053","0.001","90","0.02","6416.59","0.11","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27.5 H29.25 F6 N3 O6.13 P2 Re -","- C27.5 H29.25 F6 N3 O6.125 P2 Re -","- C220 H234 F48 N24 O49 P16 Re8 -","8","2","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54184","CUKα","","0.0724","0.0666","","","0.1564","0.1582","","","","","","1.247","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079153","8.9977","0.0003","22.9216","0.0006","11.8033","0.0003","90","0.02","91.1","0.02","90","0.02","2433.88","0.12","133","2","133","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H15 F3 N3 O7 Re S -","- C24 H15 F3 N3 O7 Re S -","- C96 H60 F12 N12 O28 Re4 S4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54184","CUKα","","0.0298","0.0294","","","0.0786","0.0789","","","","","","1.145","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079154","13.888","0.0006","8.7445","0.0004","24.6995","0.001","90","","98.706","0.004","90","","2965","0.2","133","2","133","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30 H24 F3 N3 O5 P Re S -","- C30 H24 F3 N3 O5 P Re S -","- C120 H96 F12 N12 O20 P4 Re4 S4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54184","CUKα","","0.0402","0.038","","","0.1049","0.1075","","","","","","1.034","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079155","11.9288","0.0004","17.8388","0.0005","17.6239","0.0005","90","","107.215","0.004","90","","3582.3","0.2","133","2","133","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C35 H26 F3 N3 O5 P Re S -","- C35 H26 F3 N3 O5 P Re S -","- C140 H104 F12 N12 O20 P4 Re4 S4 -","4","1","","Ko, Chi-Chiu; Ng, Chi-On; Yiu, Shek-Man","Luminescent Rhenium(I) Phenanthroline Complexes with a Benzoxazol-2-ylidene Ligand: Synthesis, Characterization, and Photophysical Study","Organometallics","2012","31","20","7074","","10.1021/om300526e","","","1.54184","CUKα","","0.0388","0.0348","","","0.0896","0.0929","","","","","","1.043","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079156","23.123","0.005","8.9946","0.0018","24.82","0.005","90","","94.149","0.005","90","","5148.6","1.8","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C53.5 H70 Cl N4 O Yb -","- C53.5 H58 Cl N4 O Yb -","- C214 H232 Cl4 N16 O4 Yb4 -","4","1","","Shen, Xiaodong; Xue, Mingqiang; Jiao, Rui; Ma, Yong; Zhang, Yong; Shen, Qi","Bis(β-diketiminate) Rare-Earth-Metal Borohydrides: Syntheses, Structures, and Catalysis for the Polymerizations ofl-Lactide, ε-Caprolactone, and Methyl Methacrylate","Organometallics","2012","31","17","6222","","10.1021/om3005299","","","0.7107","MoKα","","0.0659","0.054","","","0.1135","0.1192","","","","","","1.151","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079157","9.062","0.0006","12.4085","0.0012","20.938","0.002","86.514","0.006","81.914","0.005","82.017","0.006","2306.3","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C49.5 H66 B N4 Y -","- C49.5 H62 B N4 Y -","- C99 H124 B2 N8 Y2 -","2","1","","Shen, Xiaodong; Xue, Mingqiang; Jiao, Rui; Ma, Yong; Zhang, Yong; Shen, Qi","Bis(β-diketiminate) Rare-Earth-Metal Borohydrides: Syntheses, Structures, and Catalysis for the Polymerizations ofl-Lactide, ε-Caprolactone, and Methyl Methacrylate","Organometallics","2012","31","17","6222","","10.1021/om3005299","","","0.71075","MoKα","","0.1287","0.087","","","0.1912","0.2134","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079158","22.0087","0.0017","8.489","0.0004","16.4327","0.0013","90","","129.771","0.001","90","","2359.7","0.3","223","2","223","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C50 H70 B N4 O Yb -","- C50 H62 B N4 O Yb -","- C100 H124 B2 N8 O2 Yb2 -","2","0.5","","Shen, Xiaodong; Xue, Mingqiang; Jiao, Rui; Ma, Yong; Zhang, Yong; Shen, Qi","Bis(β-diketiminate) Rare-Earth-Metal Borohydrides: Syntheses, Structures, and Catalysis for the Polymerizations ofl-Lactide, ε-Caprolactone, and Methyl Methacrylate","Organometallics","2012","31","17","6222","","10.1021/om3005299","","","0.71075","MoKα","","0.0323","0.0312","","","0.0664","0.0667","","","","","","1.02","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079159","22.685","0.005","38.486","0.006","8.1013","0.0013","90","","90","","90","","7073","2","223","2","223","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C38 H46 B N4 Y -","- C38 H46 B N4 Y -","- C304 H368 B8 N32 Y8 -","8","0.5","","Shen, Xiaodong; Xue, Mingqiang; Jiao, Rui; Ma, Yong; Zhang, Yong; Shen, Qi","Bis(β-diketiminate) Rare-Earth-Metal Borohydrides: Syntheses, Structures, and Catalysis for the Polymerizations ofl-Lactide, ε-Caprolactone, and Methyl Methacrylate","Organometallics","2012","31","17","6222","","10.1021/om3005299","","","0.71075","MoKα","","0.0698","0.0466","","","0.0664","0.075","","","","","","0.914","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079160","21.2509","0.0017","12.8271","0.001","16.7357","0.0013","90","","105.587","0.002","90","","4394.2","0.6","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H62 B N4 O2 Yb -","- C46 H46 B N4 O2 Yb -","- C184 H184 B4 N16 O8 Yb4 -","4","0.5","","Shen, Xiaodong; Xue, Mingqiang; Jiao, Rui; Ma, Yong; Zhang, Yong; Shen, Qi","Bis(β-diketiminate) Rare-Earth-Metal Borohydrides: Syntheses, Structures, and Catalysis for the Polymerizations ofl-Lactide, ε-Caprolactone, and Methyl Methacrylate","Organometallics","2012","31","17","6222","","10.1021/om3005299","","","0.71075","MoKα","","0.0359","0.0336","","","0.087","0.0885","","","","","","1.078","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079161","9.75","0.0004","15.3223","0.0007","22.0934","0.0009","90","","90.538","0.002","90","","3300.4","0.2","293","","293","","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H34 Cl Cu N8 -","- C27 H34 Cl Cu N8 -","- C108 H136 Cl4 Cu4 N32 -","4","1","","Gibard, Clémentine; Avignant, Daniel; Cisnetti, Federico; Gautier, Arnaud","CuAAC Functionalization of Azide-Tagged Copper(I)-NHCs Acting as Catalyst and Substrate","Organometallics","2012","31","22","7902","","10.1021/om3005355","","","0.71073","MoKα","","0.1106","0.0527","","0.1443","0.0552","0.0529","","","","","","1.068","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079162","8.23","0.003","21.745","0.007","9.403","0.003","90","","100.924","0.003","90","","1652.3","1","106","2","106","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Ditrifluoroacetategoldtolylpyridine","","- C16 H10 Au F6 N O4 -","- C16 H10 Au F6 N O4 -","- C64 H40 Au4 F24 N4 O16 -","4","1","","Langseth, Eirin; Görbitz, Carl Henrik; Heyn, Richard H.; Tilset, Mats","Versatile Methods for Preparation of New Cyclometalated Gold(III) Complexes","Organometallics","2012","31","18","6567","","10.1021/om300537a","","","0.71073","MoKα","","0.0561","0.048","","","0.1362","0.1425","","","","","","1.139","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079163","4.9545","0.0003","8.5064","0.0005","28.892","0.0017","90","","90","","90","","1217.65","0.13","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Dimethylgoldtolylpyridine","","- C14 H16 Au N -","- C14 H16 Au N -","- C56 H64 Au4 N4 -","4","1","","Langseth, Eirin; Görbitz, Carl Henrik; Heyn, Richard H.; Tilset, Mats","Versatile Methods for Preparation of New Cyclometalated Gold(III) Complexes","Organometallics","2012","31","18","6567","","10.1021/om300537a","","","0.71073","MoKα","","0.0424","0.0316","","","0.0548","0.057","","","","","","1.098","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079164","16.7538","0.0004","8.615","0.0002","17.6515","0.0004","90","","110.52","0.001","90","","2386.06","0.1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Br2 N4 Pt -","- C20 H20 Br2 N4 Pt -","- C80 H80 Br8 N16 Pt4 -","4","1","","Moustafa, Mohamed E.; McCready, Matthew S.; Puddephatt, Richard J.","Switching by Photochemicaltrans‒cisIsomerization of Azobenzene Substituents in Organoplatinum Complexes","Organometallics","2012","31","17","6262","","10.1021/om3005405","","","0.71073","MoKα","","0.0347","0.0245","","","0.0555","0.0583","","","","","","1.044","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079165","7.7382","0.0004","13.0717","0.0008","13.3867","0.0013","114.095","0.002","91.776","0.002","106.269","0.001","1170.17","0.15","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 I3 N4 Pt -","- C20 H20 I3 N4 Pt -","- C40 H40 I6 N8 Pt2 -","2","1","","Moustafa, Mohamed E.; McCready, Matthew S.; Puddephatt, Richard J.","Switching by Photochemicaltrans‒cisIsomerization of Azobenzene Substituents in Organoplatinum Complexes","Organometallics","2012","31","17","6262","","10.1021/om3005405","","","0.71073","MoKα","","0.0481","0.0365","","","0.0956","0.1053","","","","","","1.047","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079166","7.4445","0.0015","7.8799","0.0016","19.855","0.004","94.28","0.03","97.39","0.03","107.26","0.03","1095.2","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H23 I N4 Pt -","- C21 H23 I N4 Pt -","- C42 H46 I2 N8 Pt2 -","2","1","","Moustafa, Mohamed E.; McCready, Matthew S.; Puddephatt, Richard J.","Switching by Photochemicaltrans‒cisIsomerization of Azobenzene Substituents in Organoplatinum Complexes","Organometallics","2012","31","17","6262","","10.1021/om3005405","","","0.71073","MoKα","","0.0467","0.0393","","","0.1107","0.1281","","","","","","1.097","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079167","11.4006","0.0004","7.6959","0.0003","17.9355","0.0006","90","","108.246","0.001","90","","1494.5","0.09","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 N2 -","- C19 H20 N2 -","- C76 H80 N8 -","4","1","","Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T.","Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity","Organometallics","2012","31","17","6244","","10.1021/om3005417","","","0.71073","MoKα","","0.0462","0.0426","","","0.1153","0.1191","","","","","","1.035","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079168","19.356","0.0008","10.8341","0.0005","19.6206","0.0008","90","","90.103","0.002","90","","4114.5","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H57 Hf N2 -","- C51 H57 Hf N2 -","- C204 H228 Hf4 N8 -","4","1","","Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T.","Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity","Organometallics","2012","31","17","6244","","10.1021/om3005417","","","0.71073","MoKα","","0.0328","0.0223","","","0.0437","0.0465","","","","","","1.008","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079169","10.6885","0.0003","11.3828","0.0003","15.1933","0.0004","106.745","0.001","90.482","0.001","101.713","0.001","1728.83","0.08","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H42 Hf N2 -","- C44 H42 Hf N2 -","- C88 H84 Hf2 N4 -","2","1","","Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T.","Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity","Organometallics","2012","31","17","6244","","10.1021/om3005417","","","0.71073","MoKα","","0.0151","0.014","","","0.0345","0.0349","","","","","","1.048","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079170","10.7327","0.0005","11.4756","0.0005","15.0593","0.0007","103.969","0.002","101.89","0.002","103.388","0.002","1682.26","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C42.5 H42 Hf N2 -","- C42.5 H42 Hf N2 -","- C85 H84 Hf2 N4 -","2","1","","Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T.","Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity","Organometallics","2012","31","17","6244","","10.1021/om3005417","","","0.71073","MoKα","","0.0254","0.0204","","","0.041","0.0422","","","","","","1.04","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079171","10.6348","0.0008","13.7845","0.001","22.0152","0.0016","90","","96.368","0.001","90","","3207.4","0.4","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 Hf N2 -","- C40 H40 Hf N2 -","- C160 H160 Hf4 N8 -","4","1","","Fontaine, Philip P.; Klosin, Jerzy; McDougal, Nolan T.","Hafnium Amidoquinoline Complexes: Highly Active Olefin Polymerization Catalysts with Ultrahigh Molecular Weight Capacity","Organometallics","2012","31","17","6244","","10.1021/om3005417","","","0.71073","MoKα","","0.0501","0.0339","","","0.0638","0.0709","","","","","","1.053","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079172","9.0654","0.0005","9.1113","0.0005","13.9447","0.0008","78.571","0.001","75.508","0.001","74.201","0.001","1062.52","0.1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H36 Ag2 F12 N8 P2 -","- C44 H36 Ag2 F12 N8 P2 -","- C44 H36 Ag2 F12 N8 P2 -","1","0.5","","Gierz, Verena; Seyboldt, Alexander; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Speidel, Michael T.; Speiser, Bernd; Eichele, Klaus; Kunz, Doris","Dinuclear Coinage-Metal Complexes of Bis(NHC) Ligands: Structural Features and Dynamic Behavior of a Cu‒Cu Complex","Organometallics","2012","31","22","7893","","10.1021/om300544g","","","0.71073","MoKα","","0.0183","0.0179","","","0.08","0.0833","","","","","","0.82","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079173","14.1554","0.0006","30.4245","0.0012","10.8287","0.0004","90","","101.145","0.002","90","","4575.7","0.3","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C44 H36 Au2 F12 N8 P2 -","- C44 H36 Au2 F12 N8 P2 -","- C176 H144 Au8 F48 N32 P8 -","4","0.5","","Gierz, Verena; Seyboldt, Alexander; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Speidel, Michael T.; Speiser, Bernd; Eichele, Klaus; Kunz, Doris","Dinuclear Coinage-Metal Complexes of Bis(NHC) Ligands: Structural Features and Dynamic Behavior of a Cu‒Cu Complex","Organometallics","2012","31","22","7893","","10.1021/om300544g","","","0.71073","MoKα","","0.028","0.0263","","","0.0594","0.0605","","","","","","1.113","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079174","21.6031","0.0011","23.3502","0.0011","19.875","0.001","90","","90","","90","","10025.7","0.9","100","2","100","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C46 H40 Cl4 Cu2 F12 N8 P2 -","- C46 H40 Cl4 Cu2 F12 N8 P2 -","- C368 H320 Cl32 Cu16 F96 N64 P16 -","8","0.5","","Gierz, Verena; Seyboldt, Alexander; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Speidel, Michael T.; Speiser, Bernd; Eichele, Klaus; Kunz, Doris","Dinuclear Coinage-Metal Complexes of Bis(NHC) Ligands: Structural Features and Dynamic Behavior of a Cu‒Cu Complex","Organometallics","2012","31","22","7893","","10.1021/om300544g","","","0.71073","MoKα","","0.0328","0.0295","","","0.0716","0.0744","","","","","","1.04","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079175","10.8315","0.0005","11.6081","0.0005","19.9343","0.0008","83.369","0.004","89.53","0.004","86.773","0.004","2485.68","0.19","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H55.72 F3 N5 O5.36 Pd2 S -","- C52 H55 F3 N5 O5.356 Pd2 S -","- C104 H110 F6 N10 O10.712 Pd4 S2 -","2","1","","Chicote, María-Teresa; Vicente-Hernández, Inmaculada; Jones, Peter G.; Vicente, José","The First Complexes with Two Metallacycles Fused Around a Common Aryl Substituent: “Akimbo” Complexes","Organometallics","2012","31","17","6252","","10.1021/om300545k","","","1.54184","CuKα","","0.0522","0.0503","","","0.1216","0.123","","","","","","1.026","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079176","10.554","0.002","16.239","0.003","17.145","0.003","73.875","0.008","72.862","0.007","81.53","0.009","2690.6","0.9","113","","113","","","","","","","","","5","P -1","-P 1","2","","","","- C64 H60 Cl2 O4 Si2 -","- C64 H52 Cl2 O4 Si2 -","- C128 H104 Cl4 O8 Si4 -","2","1","","Tanabe, Makoto; Yumoto, Ryouhei; Osakada, Kohtaro; Sanji, Takanobu; Tanaka, Masato","Preparation and Properties of Perarylated 3,4-Disila-1,5-hexadienes. A Fluorescent Disilane Accommodated in the Crystal Lattice","Organometallics","2012","31","19","6787","","10.1021/om300551t","","","0.7107","MoKα","","0.1211","0.0835","","","0.2272","0.2517","","","","","","1.249","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079177","10.128","0.006","10.558","0.006","11.947","0.006","63.53","0.03","74.68","0.04","79.16","0.04","1099.3","1.1","113","","113","","","","","","","","","3","P -1","-P 1","2","","","","- C56 H50 Si2 -","- C56 H50 Si2 -","- C56 H50 Si2 -","1","0.5","","Tanabe, Makoto; Yumoto, Ryouhei; Osakada, Kohtaro; Sanji, Takanobu; Tanaka, Masato","Preparation and Properties of Perarylated 3,4-Disila-1,5-hexadienes. A Fluorescent Disilane Accommodated in the Crystal Lattice","Organometallics","2012","31","19","6787","","10.1021/om300551t","","","0.7107","MoKα","","0.0951","0.0548","","","0.1213","0.1443","","","","","","0.94","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079178","10.1977","0.0012","15.0821","0.0017","18.091","0.003","70.922","0.007","77.663","0.007","66.104","0.006","2393.6","0.6","113","","113","","","","","","","","","4","P -1","-P 1","2","","","","- C56 H38 F12 Si2 -","- C56 H38 F12 Si2 -","- C112 H76 F24 Si4 -","2","1","","Tanabe, Makoto; Yumoto, Ryouhei; Osakada, Kohtaro; Sanji, Takanobu; Tanaka, Masato","Preparation and Properties of Perarylated 3,4-Disila-1,5-hexadienes. A Fluorescent Disilane Accommodated in the Crystal Lattice","Organometallics","2012","31","19","6787","","10.1021/om300551t","","","0.7107","MoKα","","0.1114","0.0795","","","0.2038","0.2225","","","","","","1.004","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079179","9.504","0.004","12.433","0.005","12.806","0.005","103.954","0.005","94.733","0.004","105.892","0.005","1394.4","1","113","","113","","","","","","","","","4","P -1","-P 1","2","","","","- C70 H54 N4 Si2 -","- C70 H54 N4 Si2 -","- C70 H54 N4 Si2 -","1","0.5","","Tanabe, Makoto; Yumoto, Ryouhei; Osakada, Kohtaro; Sanji, Takanobu; Tanaka, Masato","Preparation and Properties of Perarylated 3,4-Disila-1,5-hexadienes. A Fluorescent Disilane Accommodated in the Crystal Lattice","Organometallics","2012","31","19","6787","","10.1021/om300551t","","","0.7107","MoKα","","0.101","0.08","","","0.2163","0.2392","","","","","","1.343","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079180","8.59","0.003","9.837","0.003","21.36","0.007","101.861","0.007","91.029","0.007","97.388","0.006","1749.9","1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H17 Br N2 -","- C22 H17 Br N2 -","- C88 H68 Br4 N8 -","4","2","","John, Alex; Nicholas, Kenneth M.","Copper-Mediated Multiple C–H Functionalization of AromaticN-Heterocycles: Bromoamination of Indoles and Pyrroles","Organometallics","2012","31","22","7914","","10.1021/om300553b","","","0.71073","MoKα","","0.084","0.0602","","","0.1651","0.1754","","","","","","1.088","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079181","16.756","0.0018","21.766","0.002","19.5","0.002","90","","98.504","0.002","90","","7033.7","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H52 Hf2 N2 O2 -","- C38 H52 Hf2 N2 O2 -","- C304 H416 Hf16 N16 O16 -","8","2","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0677","0.0364","","","0.0618","0.0677","","","","","","1.088","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079182","10.709","0.005","12.121","0.005","15.003","0.005","73.565","0.005","73.88","0.005","80.049","0.005","1785","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H104 Hf4 N4 O6 -","- C76 H104 Hf4 N4 O6 -","- C76 H104 Hf4 N4 O6 -","1","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0403","0.026","","","0.0603","0.0783","","","","","","1.114","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079183","9.588","0.005","10.972","0.005","11.333","0.005","87.33","0.005","69.543","0.005","87.477","0.005","1115.3","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H72 Hf2 N2 O2 Si2 -","- C46 H72 Hf2 N2 O2 Si2 -","- C46 H72 Hf2 N2 O2 Si2 -","1","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0143","0.013","","","0.0309","0.0313","","","","","","1.03","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079184","18.113","0.0016","21.725","0.002","10.8591","0.001","90","","97.353","0.002","90","","4238","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C92 H122 Hf4 N6 O6 -","- C92 H122 Hf4 N6 O6 -","- C184 H244 Hf8 N12 O12 -","2","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0476","0.0364","","","0.0804","0.0843","","","","","","1.081","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079185","20.209","0.005","12.339","0.005","17.859","0.005","90","","106.585","0.005","90","","4268","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H62 Hf2 N4 O4 -","- C44 H62 Hf2 N4 O4 -","- C176 H248 Hf8 N16 O16 -","4","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0301","0.0203","","","0.0485","0.0634","","","","","","1.117","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079186","20.209","0.005","9.345","0.005","16.632","0.005","90","","98.321","0.005","90","","3108","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H44 Hf2 N2 O2 -","- C34 H44 Hf2 N2 O2 -","- C136 H176 Hf8 N8 O8 -","4","1","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0525","0.0445","","","0.1323","0.141","","","","","","1.155","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079187","31.222","0.003","9.6875","0.0009","22.409","0.002","90","","133.666","0.001","90","","4903","0.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H76 Hf2 N2 O3.92 Si2 -","- C50 H76 Hf2 N2 O3.924 Si2 -","- C200 H304 Hf8 N8 O15.696 Si8 -","4","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0218","0.0194","","","0.039","0.0394","","","","","","1.221","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079188","9.3702","0.001","16.9273","0.0019","23.057","0.003","78.706","0.002","86.968","0.003","88.166","0.002","3580.4","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C149.03 H188 F4 Hf8 I4 N3.03 O7.03 -","- C149.033 H188 F4 Hf8 I4 N3.0328 O7.0328 -","- C149.033 H188 F4 Hf8 I4 N3.0328 O7.0328 -","1","0.5","","Semproni, Scott P.; Margulieux, Grant W.; Chirik, Paul J.","Di- and Tetrametallic Hafnocene Oxamidides Prepared from CO-Induced N2Bond Cleavage and Thermal Rearrangement to Hafnocene Cyanide Derivatives","Organometallics","2012","31","17","6278","","10.1021/om3005542","","","0.71073","MoKα","","0.0493","0.0424","","","0.0965","0.101","","","","","","1.194","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079189","7.589","0.004","13.7459","0.0012","14.8097","0.0018","109.43","0.008","101.394","0.005","98.23","0.007","1391.3","0.8","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C28 H64 Cu4 I4 N30 O2 P4 -","- C28 H64 Cu4 I4 N30 O2 P4 -","- C28 H64 Cu4 I4 N30 O2 P4 -","1","0.5","","Kirillov, Alexander M.; Filipowicz, Małgorzata; Guedes da Silva, M. Fátima C.; Kłak, Julia; Smoleński, Piotr; Pombeiro, Armando J. L.","Unprecedented Mixed-Valence Cu(I)/Cu(II) Complex Derived fromN-Methyl-1,3,5-triaza-7-phosphaadamantane: Synthesis, Structural Features, and Magnetic Properties","Organometallics","2012","31","22","7921","","10.1021/om3005564","","","0.71069","MoKα","","0.0372","0.0294","","","0.0716","0.0758","","","","","","1.02","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079190","11.3575","0.0016","18.976","0.002","35.022","0.003","90","","90","","90","","7547.9","1.5","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C35 H32 F9 Ir N4 O3 S -","- C35 H32 F9 Ir N4 O3 S -","- C280 H256 F72 Ir8 N32 O24 S8 -","8","1","","Shavaleev, Nail M.; Monti, Filippo; Scopelliti, Rosario; Armaroli, Nicola; Grätzel, Michael; Nazeeruddin, Mohammad K.","Blue Phosphorescence of Trifluoromethyl- and Trifluoromethoxy-Substituted Cationic Iridium(III) Isocyanide Complexes","Organometallics","2012","31","17","6288","","10.1021/om300557d","","","0.71073","MoKα","","0.0182","0.0159","","","0.0367","0.0381","","","","","","1.224","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079191","14.4301","0.0018","16.0365","0.0016","20.574","0.004","97.072","0.011","106.481","0.01","104.78","0.009","4315.1","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H30 F15 Ir N4 O3 S -","- C37 H30 F15 Ir N4 O3 S -","- C148 H120 F60 Ir4 N16 O12 S4 -","4","2","","Shavaleev, Nail M.; Monti, Filippo; Scopelliti, Rosario; Armaroli, Nicola; Grätzel, Michael; Nazeeruddin, Mohammad K.","Blue Phosphorescence of Trifluoromethyl- and Trifluoromethoxy-Substituted Cationic Iridium(III) Isocyanide Complexes","Organometallics","2012","31","17","6288","","10.1021/om300557d","","","0.71073","MoKα","","0.0501","0.0303","","","0.0695","0.0817","","","","","","1.15","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079192","13.4577","0.0018","13.602","0.002","22.574","0.004","102.632","0.015","95.986","0.011","91.729","0.013","4004.2","1.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H32 F9 Ir N4 O5 S -","- C35 H32 F9 Ir N4 O5 S -","- C140 H128 F36 Ir4 N16 O20 S4 -","4","2","","Shavaleev, Nail M.; Monti, Filippo; Scopelliti, Rosario; Armaroli, Nicola; Grätzel, Michael; Nazeeruddin, Mohammad K.","Blue Phosphorescence of Trifluoromethyl- and Trifluoromethoxy-Substituted Cationic Iridium(III) Isocyanide Complexes","Organometallics","2012","31","17","6288","","10.1021/om300557d","","","0.71073","MoKα","","0.0771","0.0617","","","0.1496","0.1605","","","","","","1.239","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079193","13.221","0.002","13.629","0.002","22.862","0.005","90","","95.2","0.013","90","","4102.5","1.2","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H34 Cl2 F9 Ir N4 O3 S -","- C36 H34 Cl2 F9 Ir N4 O3 S -","- C144 H136 Cl8 F36 Ir4 N16 O12 S4 -","4","1","","Shavaleev, Nail M.; Monti, Filippo; Scopelliti, Rosario; Armaroli, Nicola; Grätzel, Michael; Nazeeruddin, Mohammad K.","Blue Phosphorescence of Trifluoromethyl- and Trifluoromethoxy-Substituted Cationic Iridium(III) Isocyanide Complexes","Organometallics","2012","31","17","6288","","10.1021/om300557d","","","0.71073","MoKα","","0.1056","0.0927","","","0.2594","0.2672","","","","","","1.327","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079194","13.3214","0.0012","19.264","0.005","30.362","0.006","90","","90","","90","","7792","3","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C35 H32 F9 Ir N4 O5 S -","- C35 H32 F9 Ir N4 O5 S -","- C280 H256 F72 Ir8 N32 O40 S8 -","8","1","","Shavaleev, Nail M.; Monti, Filippo; Scopelliti, Rosario; Armaroli, Nicola; Grätzel, Michael; Nazeeruddin, Mohammad K.","Blue Phosphorescence of Trifluoromethyl- and Trifluoromethoxy-Substituted Cationic Iridium(III) Isocyanide Complexes","Organometallics","2012","31","17","6288","","10.1021/om300557d","","","0.71073","MoKα","","0.067","0.0443","","","0.088","0.0979","","","","","","1.336","","","","has coordinates,has disorder","178680","2020-10-21","18:00:00",""
"4079195","13.8499","0.0004","13.3155","0.0003","27.0349","0.0008","90","","90","","90","","4985.7","0.2","115","2","115","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H30 Fe N6 P2 Se2 -","- C20 H30 Fe N6 P2 Se2 -","- C160 H240 Fe8 N48 P16 Se16 -","8","1","","Marchenko, Anatolyi; Hurieva, Anastasiya; Koidan, Heorgii; Rampazzi, Vincent; Cattey, Hélène; Pirio, Nadine; Kostyuk, Aleksandr N.; Hierso, Jean-Cyrille","First Annelated Azaphosphole-Ferrocenes: Synthetic Pathways and Structures","Organometallics","2012","31","17","5986","","10.1021/om300563n","","","0.71073","MoKα","","0.0291","0.0243","","","0.0524","0.0549","","","","","","1.069","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079196","9.4668","0.0003","23.7224","0.0007","7.2805","0.0002","90","","96.985","0.001","90","","1622.88","0.08","115","2","115","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 Fe N3 P Se -","- C15 H20 Fe N3 P Se -","- C60 H80 Fe4 N12 P4 Se4 -","4","1","","Marchenko, Anatolyi; Hurieva, Anastasiya; Koidan, Heorgii; Rampazzi, Vincent; Cattey, Hélène; Pirio, Nadine; Kostyuk, Aleksandr N.; Hierso, Jean-Cyrille","First Annelated Azaphosphole-Ferrocenes: Synthetic Pathways and Structures","Organometallics","2012","31","17","5986","","10.1021/om300563n","","","0.71073","MoKα","","0.0229","0.0215","","","0.0513","0.0523","","","","","","1.073","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079197","9.9218","0.0002","10.0176","0.0002","25.3743","0.0006","89.1691","0.0009","85.176","0.0011","62.253","0.001","2223.24","0.08","115","2","115","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H30 Fe N6 P2 -","- C20 H30 Fe N6 P2 -","- C80 H120 Fe4 N24 P8 -","4","2","","Marchenko, Anatolyi; Hurieva, Anastasiya; Koidan, Heorgii; Rampazzi, Vincent; Cattey, Hélène; Pirio, Nadine; Kostyuk, Aleksandr N.; Hierso, Jean-Cyrille","First Annelated Azaphosphole-Ferrocenes: Synthetic Pathways and Structures","Organometallics","2012","31","17","5986","","10.1021/om300563n","","","0.71073","MoKα","","0.0398","0.0334","","","0.0722","0.0768","","","","","","1.093","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079198","20.1608","0.0005","11.2594","0.0004","13.2055","0.0004","90","","90","","90","","2997.63","0.16","115","2","115","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C15 H20 Fe N3 P -","- C15 H20 Fe N3 P -","- C120 H160 Fe8 N24 P8 -","8","2","","Marchenko, Anatolyi; Hurieva, Anastasiya; Koidan, Heorgii; Rampazzi, Vincent; Cattey, Hélène; Pirio, Nadine; Kostyuk, Aleksandr N.; Hierso, Jean-Cyrille","First Annelated Azaphosphole-Ferrocenes: Synthetic Pathways and Structures","Organometallics","2012","31","17","5986","","10.1021/om300563n","","","0.71073","MoKα","","0.0252","0.0243","","","0.0585","0.059","","","","","","1.102","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079199","18.704","0.005","13.274","0.004","8.821","0.004","90","","90","","90","","2190.1","1.3","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C20 H34 Fe Si3 -","- C20 H34 Fe Si3 -","- C80 H136 Fe4 Si12 -","4","1","","Braunschweig, Holger; Damme, Alexander; Hammond, Kai; Mager, Julian","Synthesis and Structure of New [3]Silametallocenophanes of Group 8 Metals","Organometallics","2012","31","17","6317","","10.1021/om300564y","","","0.71073","MoKα","","0.0169","0.0164","","","0.0435","0.0438","","","","","","1.083","","","","has coordinates","178680","2020-10-21","18:00:00",""
"4079200","23.6938","0.0018","9.3704","0.0007","7.3889","0.0005","90","","91.495","0.003","90","","1639.9","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 N6 O5 W -","- C14 N6 O5 W -","- C56 N24 O20 W4 -","4","1","","Bubrin, Martina; Krafft, Michael J.; Steudle, Lisa; Hübner, Ralph; Field, John S.; Záliš, Stanislav; Kaim, Wolfgang","Structural Reassessment of [W(CO)5(TCNE)]: N (σ) Coordination Instead of an Olefin (π) Complex","Organometallics","2012","31","17","6305","","10.1021/om300565q","","","0.71073","MoKα","","0.1168","0.0703","","","0.1515","0.1636","","","","","","1.252","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079201","32.15","0.003","12.362","0.0011","28.19","0.003","90","","92.489","0.002","90","","11193.2","1.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H52 N2 Ni -","- C43 H52 N2 Ni -","- C516 H624 N24 Ni12 -","12","3","","Iglesias, Mar José; Blandez, Juan F.; Fructos, Manuel R.; Prieto, Auxiliadora; Álvarez, Eleuterio; Belderrain, Tom R.; Nicasio, M. Carmen","Synthesis, Structural Characterization, and Catalytic Activity of IPrNi(styrene)2in the Amination of Aryl Tosylates","Organometallics","2012","31","17","6312","","10.1021/om300566m","","","0.71073","MoKα","","0.1754","0.0597","","","0.1224","0.1667","","","","","","0.972","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079202","13.0765","0.0005","9.4012","0.0003","23.2484","0.0008","90","","96.641","0.001","90","","2838.86","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[N{(C3F7)C(2-F,6-(CF3)C6H3)N}2]Cu(C2H4)","","","- C24 H10 Cu F22 N3 -","- C24 H10 Cu F22 N3 -","- C96 H40 Cu4 F88 N12 -","4","1","","Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika","Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups","Organometallics","2012","31","22","7926","","10.1021/om300567v","","","0.71073","MoKα","","0.0266","0.0252","","","0.0663","0.0671","","","","","","1.056","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079203","7.532","0.0004","22.7008","0.0011","8.7206","0.0004","90","","105.393","0.001","90","","1437.58","0.12","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","[N{(C3F7)C(2-(CF3)C6H3)N}2]Cu(C2H4)","","","- C24 H12 Cu F20 N3 -","- C24 H12 Cu F20 N3 -","- C48 H24 Cu2 F40 N6 -","2","0.5","","Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika","Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups","Organometallics","2012","31","22","7926","","10.1021/om300567v","","","0.71073","MoKα","","0.043","0.0418","","","0.1155","0.118","","","","","","1.051","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079204","15.569","0.002","12.2726","0.0017","16.054","0.002","90","","117.637","0.002","90","","2717.5","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[N{(C3F7)C(4-(NO2)C6H4)N}2]Cu(C2H4)","","","- C22 H12 Cu F14 N5 O4 -","- C22 H12 Cu F14 N5 O4 -","- C88 H48 Cu4 F56 N20 O16 -","4","1","","Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika","Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups","Organometallics","2012","31","22","7926","","10.1021/om300567v","","","0.71073","MoKα","","0.1216","0.0944","","","0.2583","0.2832","","","","","","1.088","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079205","12.31","0.002","5.8233","0.0009","36.666","0.006","90","","96.361","0.002","90","","2612.2","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[N{(C3F7)C(2-(NO2)C6H4)N}2]Cu(C2H4)","","","- C22 H12 Cu F14 N5 O4 -","- C22 H12 Cu F14 N5 O4 -","- C88 H48 Cu4 F56 N20 O16 -","4","1","","Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika","Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups","Organometallics","2012","31","22","7926","","10.1021/om300567v","","","0.71073","MoKα","","0.0749","0.0512","","","0.119","0.1308","","","","","","1.009","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079206","11.4598","0.0011","21.38","0.002","11.9051","0.0011","90","","93.8","0.001","90","","2910.5","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[N{(C3F7)C(4-NO2C6H4)N}2]Cu(CO)(NCCH3)","","","- C23 H11 Cu F14 N6 O5 -","- C23 H11 Cu F14 N6 O5 -","- C92 H44 Cu4 F56 N24 O20 -","4","1","","Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika","Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups","Organometallics","2012","31","22","7926","","10.1021/om300567v","","","0.71073","MoKα","","0.0739","0.0517","","","0.1325","0.147","","","","","","1.034","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079207","8.744","0.004","14.245","0.01","14.976","0.01","90","","93.3","0.04","90","","1862","2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","6a","3-ethoxy-2,2,5-triphenyl-2H-pyrrole","","- C24 H21 N O -","- C24 H21 N O -","- C96 H84 N4 O4 -","4","1","","González, Héctor F.; Blanco-Lomas, Marina; Rivado-Casas, Laura; Rodr\?íguez, Miguel A.; Campos, Pedro J.; Sampedro, Diego","Addition of Oxime Derivatives to Alkynyl Fischer Carbene Complexes","Organometallics","2012","31","18","6572","","10.1021/om300570q","","","0.71073","MoKα","","0.0709","0.058","","","0.1499","0.1646","","","","","","1.053","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079208","10.758","0.001","13.473","0.002","13.518","0.002","90","","102.87","0.01","90","","1910.1","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","7a","3-ethoxy-1,5-diphenyl-3H-benzo[c]azepine","","- C24 H21 N O -","- C24 H21 N O -","- C96 H84 N4 O4 -","4","1","","González, Héctor F.; Blanco-Lomas, Marina; Rivado-Casas, Laura; Rodr\?íguez, Miguel A.; Campos, Pedro J.; Sampedro, Diego","Addition of Oxime Derivatives to Alkynyl Fischer Carbene Complexes","Organometallics","2012","31","18","6572","","10.1021/om300570q","","","0.71073","MoKα","","0.1268","0.0538","","","0.1037","0.1305","","","","","","1.156","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079209","13.053","0.002","9.954","0.001","18.354","0.001","90","","129.286","0.01","90","","1845.8","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","8a","5-ethoxy-2,2,3-triphenyl-2H-pyrrole","","- C24 H21 N O -","- C24 H21 N O -","- C96 H84 N4 O4 -","4","1","","González, Héctor F.; Blanco-Lomas, Marina; Rivado-Casas, Laura; Rodr\?íguez, Miguel A.; Campos, Pedro J.; Sampedro, Diego","Addition of Oxime Derivatives to Alkynyl Fischer Carbene Complexes","Organometallics","2012","31","18","6572","","10.1021/om300570q","","","0.71073","MoKα","","0.1215","0.065","","","0.1452","0.1764","","","","","","1.039","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079210","11.93","0.006","11.237","0.004","13.729","0.006","90","","91.24","0.02","90","","1840","1.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","8b","5'-ethoxy-3'-phenylspiro[fluorene-9,2'-pyrrole]","","- C24 H19 N O -","- C24 H19 N O -","- C96 H76 N4 O4 -","4","1","","González, Héctor F.; Blanco-Lomas, Marina; Rivado-Casas, Laura; Rodr\?íguez, Miguel A.; Campos, Pedro J.; Sampedro, Diego","Addition of Oxime Derivatives to Alkynyl Fischer Carbene Complexes","Organometallics","2012","31","18","6572","","10.1021/om300570q","","","0.71073","MoKα","","0.0871","0.0534","","","0.1216","0.1393","","","","","","1.075","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079211","7.118","0.001","19.666","0.001","21.805","0.001","90","","90","","90","","3052.3","0.5","173","2","173","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","9c","2-ethoxy-4-phenyl-5H-indeno[1,2-b]pyridine","","- C20 H17 N O -","- C20 H17 N O -","- C160 H136 N8 O8 -","8","1","","González, Héctor F.; Blanco-Lomas, Marina; Rivado-Casas, Laura; Rodr\?íguez, Miguel A.; Campos, Pedro J.; Sampedro, Diego","Addition of Oxime Derivatives to Alkynyl Fischer Carbene Complexes","Organometallics","2012","31","18","6572","","10.1021/om300570q","","","0.71073","MoKα","","0.0651","0.0424","","","0.0963","0.1073","","","","","","1.034","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079212","13.161","0.005","16.167","0.005","17.75","0.005","90","0.005","99.998","0.005","90","0.005","3719","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C87 H80 Mo2 P4 Si2 -","- C87 H80 Mo2 P4 Si2 -","- C174 H160 Mo4 P8 Si4 -","2","0.5","","Roberts, Hannah N.; Brown, Neil J.; Edge, Ruth; Fitzgerald, Emma C.; Ta, Yien T.; Collison, David; Low, Paul J.; Whiteley, Mark W.","Synthesis, Redox Chemistry, and Electronic Structure of the Butadiynyl and Hexatriynyl Complexes [Mo{(C≡C)nC≡CR}(L2)(η-C7H7)]z+(n= 1, 2;z= 0, 1; R = SiMe3, H; L2= 2,2′-bipyridine, Ph2PCH2CH2PPh2)","Organometallics","2012","31","17","6322","","10.1021/om3005756","","","0.71073","MoKα","","0.0583","0.0329","","","0.0734","0.0786","","","","","","0.924","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079213","8.492","0.005","10.802","0.005","14.077","0.005","109.94","0.005","96.832","0.005","94.964","0.005","1194","1","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H15 Mo N2 Si -","- C26 H15 Mo N2 Si -","- C52 H30 Mo2 N4 Si2 -","2","1","","Roberts, Hannah N.; Brown, Neil J.; Edge, Ruth; Fitzgerald, Emma C.; Ta, Yien T.; Collison, David; Low, Paul J.; Whiteley, Mark W.","Synthesis, Redox Chemistry, and Electronic Structure of the Butadiynyl and Hexatriynyl Complexes [Mo{(C≡C)nC≡CR}(L2)(η-C7H7)]z+(n= 1, 2;z= 0, 1; R = SiMe3, H; L2= 2,2′-bipyridine, Ph2PCH2CH2PPh2)","Organometallics","2012","31","17","6322","","10.1021/om3005756","","","0.71073","MoKα","","0.1013","0.0534","","","0.1008","0.1137","","","","","","0.91","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079214","12.271","0.005","18.489","0.005","16.679","0.005","90","0.005","100.584","0.005","90","0.005","3720","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C85 H80 Cl2 Mo2 P4 Si2 -","- C85 H80 Cl2 Mo2 P4 Si2 -","- C170 H160 Cl4 Mo4 P8 Si4 -","2","0.5","","Roberts, Hannah N.; Brown, Neil J.; Edge, Ruth; Fitzgerald, Emma C.; Ta, Yien T.; Collison, David; Low, Paul J.; Whiteley, Mark W.","Synthesis, Redox Chemistry, and Electronic Structure of the Butadiynyl and Hexatriynyl Complexes [Mo{(C≡C)nC≡CR}(L2)(η-C7H7)]z+(n= 1, 2;z= 0, 1; R = SiMe3, H; L2= 2,2′-bipyridine, Ph2PCH2CH2PPh2)","Organometallics","2012","31","17","6322","","10.1021/om3005756","","","0.71073","MoKα","","0.0615","0.0364","","","0.084","0.0895","","","","","","0.944","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079215","17.212","0.005","19.886","0.006","21.885","0.007","90","","90","","90","","7491","4","153","2","153","2","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C39 H54 Al N3 O S -","- C39 H54 Al N3 O S -","- C312 H432 Al8 N24 O8 S8 -","8","","","Yang, Zhi; Hao, Pengfei; Liu, Zhihong; Ma, Xiaoli; Roesky, Herbert W.; Sun, Kening; Li, Jiarong","Reactivity Studies of LAlH2(L = HC(CMeNAr)2, Ar = 2,6-iPr2C6H3) with 2-Aminobenzenethiol, 2-Aminophenol, and 1,4-Dithiane-2,5-diol","Organometallics","2012","31","17","6500","","10.1021/om300577j","","","0.71073","MoKα","","0.0856","0.0775","","","0.1849","0.1915","","","","","","1.001","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4079216","11.899","0.003","38.987","0.008","17.675","0.004","90","","93.227","0.003","90","","8187","3","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C89 H114 Al2 N8 O4 -","- C89 H114 Al2 N8 O4 -","- C356 H456 Al8 N32 O16 -","4","1","","Yang, Zhi; Hao, Pengfei; Liu, Zhihong; Ma, Xiaoli; Roesky, Herbert W.; Sun, Kening; Li, Jiarong","Reactivity Studies of LAlH2(L = HC(CMeNAr)2, Ar = 2,6-iPr2C6H3) with 2-Aminobenzenethiol, 2-Aminophenol, and 1,4-Dithiane-2,5-diol","Organometallics","2012","31","17","6500","","10.1021/om300577j","","","0.71073","MoKα","","0.1652","0.1128","","","0.2849","0.3097","","","","","","1.002","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"4079217","13.737","0.002","16.871","0.003","28.096","0.005","90","","90","","90","","6511.4","1.9","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C33 H47 Al N2 O2 S2 -","- C33 H47 Al N2 O2 S2 -","- C264 H376 Al8 N16 O16 S16 -","8","1","","Yang, Zhi; Hao, Pengfei; Liu, Zhihong; Ma, Xiaoli; Roesky, Herbert W.; Sun, Kening; Li, Jiarong","Reactivity Studies of LAlH2(L = HC(CMeNAr)2, Ar = 2,6-iPr2C6H3) with 2-Aminobenzenethiol, 2-Aminophenol, and 1,4-Dithiane-2,5-diol","Organometallics","2012","31","17","6500","","10.1021/om300577j","","","0.71073","MoKα","","0.07","0.064","","","0.1388","0.1422","","","","","","1.142","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079218","10.696","0.003","20.473","0.006","19.164","0.005","90","","97.3","0.004","90","","4163","2","100","2","100.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H41 Cl4 O3 P2 Re -","- C46 H41 Cl4 O3 P2 Re -","- C184 H164 Cl16 O12 P8 Re4 -","4","1","","Poon, Ka Chun; Shi, Chuan; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Synthesis of Alkenyl Ylide Complexes from Reactions of ReOCl2(OEt)(PPh3)2with Alkynols","Organometallics","2012","31","20","7085","","10.1021/om3005788","","","0.71073","MoKα","","0.0776","0.0418","","","0.0598","0.0645","","","","","","1.003","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079219","11.5153","0.0014","11.7918","0.0014","16.5896","0.0019","83.603","0.002","74.526","0.002","67.088","0.002","1999.6","0.4","100","2","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H39 Cl4 O2 P2 Re -","- C42 H39 Cl4 O2 P2 Re -","- C84 H78 Cl8 O4 P4 Re2 -","2","1","","Poon, Ka Chun; Shi, Chuan; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Synthesis of Alkenyl Ylide Complexes from Reactions of ReOCl2(OEt)(PPh3)2with Alkynols","Organometallics","2012","31","20","7085","","10.1021/om3005788","","","0.71073","MoKα","","0.0676","0.0492","","","0.0709","0.0752","","","","","","1.004","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079220","18.1396","0.0018","12.426","0.0012","16.6718","0.0017","90","","90","","90","","3757.9","0.6","100","","100","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C41 H37 Cl2 O2 P2 Re -","- C41 H37 Cl2 O2 P2 Re -","- C164 H148 Cl8 O8 P8 Re4 -","4","1","","Poon, Ka Chun; Shi, Chuan; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Synthesis of Alkenyl Ylide Complexes from Reactions of ReOCl2(OEt)(PPh3)2with Alkynols","Organometallics","2012","31","20","7085","","10.1021/om3005788","","","0.71073","MoKα","","0.0509","0.0373","","","0.0714","0.0758","","","","","","1.021","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079221","26.984","0.0003","16.4767","0.0002","19.9199","0.0003","90","","104.205","0.001","90","","8585.7","0.2","173","2","173.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C82 H72 Cl8 O4 P4 Re2 -","- C82 H72 Cl8 O4 P4 Re2 -","- C328 H288 Cl32 O16 P16 Re8 -","4","0.5","","Poon, Ka Chun; Shi, Chuan; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Synthesis of Alkenyl Ylide Complexes from Reactions of ReOCl2(OEt)(PPh3)2with Alkynols","Organometallics","2012","31","20","7085","","10.1021/om3005788","","x-ray","1.54178","CuKα","","0.0922","0.0479","","","0.0952","0.1078","","","","","","1.025","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079222","9.0637","0.0003","14.3757","0.0005","18.2998","0.0006","70.427","0.003","82.255","0.003","80.04","0.003","2205.17","0.14","173","2","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H43 Cl6 O2 P2 Re -","- C44 H43 Cl6 O2 P2 Re -","- C88 H86 Cl12 O4 P4 Re2 -","2","1","","Poon, Ka Chun; Shi, Chuan; Sung, Herman H.-Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen","Synthesis of Alkenyl Ylide Complexes from Reactions of ReOCl2(OEt)(PPh3)2with Alkynols","Organometallics","2012","31","20","7085","","10.1021/om3005788","","x-ray","1.5418","CuKα","","0.0534","0.0501","","","0.129","0.1311","","","","","","1.024","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079223","11.739","0.006","18.534","0.008","7.757","0.004","90","","109.235","0.012","90","","1593.5","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 Cl2 Cr N2 -","- C17 H17 Cl2 Cr N2 -","- C68 H68 Cl8 Cr4 N8 -","4","1","","Sieb, David; Baker, Robert W.; Wadepohl, Hubert; Enders, Markus","Naphthyridine Cyclopentadienyl Chromium Complexes as Single-Site Catalysts for the Formation of Ultrahigh Molecular Weight Polyethylene","Organometallics","2012","31","21","7368","","10.1021/om300582j","","x-ray","0.71073","MoKα","","0.0553","0.0379","","","0.0921","0.1014","","","","","","1.062","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079224","18.718","0.008","9.487","0.004","22.399","0.011","90","","92.72","0.014","90","","3973","3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H19 Cl4 Cr N2 -","- C18 H19 Cl4 Cr N2 -","- C144 H152 Cl32 Cr8 N16 -","8","1","","Sieb, David; Baker, Robert W.; Wadepohl, Hubert; Enders, Markus","Naphthyridine Cyclopentadienyl Chromium Complexes as Single-Site Catalysts for the Formation of Ultrahigh Molecular Weight Polyethylene","Organometallics","2012","31","21","7368","","10.1021/om300582j","","x-ray","0.71073","MoKα","","0.0459","0.035","","","0.0842","0.0924","","","","","","1.063","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079225","7.183","0.003","25.925","0.012","11.043","0.006","90","","93.674","0.012","90","","2052.2","1.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl2 Cr N2 -","- C24 H25 Cl2 Cr N2 -","- C96 H100 Cl8 Cr4 N8 -","4","1","","Sieb, David; Baker, Robert W.; Wadepohl, Hubert; Enders, Markus","Naphthyridine Cyclopentadienyl Chromium Complexes as Single-Site Catalysts for the Formation of Ultrahigh Molecular Weight Polyethylene","Organometallics","2012","31","21","7368","","10.1021/om300582j","","x-ray","0.71073","MoKα","","0.0622","0.0364","","","0.0835","0.0967","","","","","","1.036","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079226","10.6501","0.0004","35.731","0.0013","10.2532","0.0003","90","","107.285","0.003","90","","3725.5","0.2","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H44 P2 Ru -","- C46 H44 P2 Ru -","- C184 H176 P8 Ru4 -","4","1","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","","0.71073","MoKα","","0.0594","0.0371","","","0.0774","0.0813","","","","","","0.942","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079227","10.523","0.001","11.313","0.001","23.935","0.003","96.928","0.003","97.902","0.003","110.162","0.003","2605.8","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H54 Au P3 Ru -","- C60 H54 Au P3 Ru -","- C120 H108 Au2 P6 Ru2 -","2","1","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","","0.71073","MoKα","","0.0741","0.0467","","","0.1176","0.1242","","","","","","1.107","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079228","48.476","0.014","18.052","0.006","20.193","0.006","90","","102.174","0.005","90","","17273","9","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46.5 H51.5 P2 Ru Si -","- C46.5 H51.5 P2 Ru Si -","- C744 H824 P32 Ru16 Si16 -","16","2","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","","0.71073","MoKα","","0.099","0.0603","","","0.138","0.1567","","","","","","1.019","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079229","47.893","0.003","17.882","0.002","20.313","0.001","90","","102.66","0.01","90","","16974","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H48 Fe P2 Si -","- C45 H48 Fe P2 Si -","- C720 H768 Fe16 P32 Si16 -","16","2","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","","1.54178","CuKα","","0.1386","0.0615","","","0.1399","0.1741","","","","","","0.945","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079230","12.6624","0.0005","14.5461","0.0006","16.485","0.0007","93.418","0.004","102.305","0.004","99.647","0.004","2910.3","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C60.98 H59.96 Au Cl5.96 Fe P3 -","- C60.979 H59.958 Au Cl5.958 Fe P3 -","- C121.958 H119.916 Au2 Cl11.916 Fe2 P6 -","2","1","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","","0.71073","MoKα","","0.0718","0.0474","","","0.102","0.1054","","","","","","0.977","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079231","10.605","0.0003","35.298","0.0011","10.3375","0.0004","90","","107.578","0.001","90","","3689","0.2","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H44 Fe P2 -","- C46 H44 Fe P2 -","- C184 H176 Fe4 P8 -","4","1","","Gendron, Frédéric; Burgun, Alexandre; Skelton, Brian W.; White, Allan H.; Roisnel, Thierry; Bruce, Michael I.; Halet, Jean-François; Lapinte, Claude; Costuas, Karine","Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}‒(C≡C)n‒R]0/+(M = Fe, Ru): An Experimental and Theoretical Investigation","Organometallics","2012","31","19","6796","","10.1021/om300584u","","x-ray","0.71073","MoKα","","0.0334","0.0293","","","0.0721","0.0744","","","","","","1.046","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079232","17.1033","0.0015","7.55022","0.00017","24.464","0.002","90","","138.854","0.017","90","","2078.6","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 Br N2 O3 Pd -","- C20 H27 Br N2 O3 Pd -","- C80 H108 Br4 N8 O12 Pd4 -","4","1","","García-López, José-Antonio; Oliva-Madrid, María-José; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Reactivity toward CO of Eight-Membered Palladacycles Derived from the Insertion of Alkenes into the Pd‒C Bond of Cyclopalladated Primary Arylalkylamines of Pharmaceutical Interest. Synthesis of Tetrahydrobenzazocinones, Ortho-Functionalized Phenethylamines, Ureas, and an Isocyanate","Organometallics","2012","31","17","6351","","10.1021/om300593x","","","0.71073","MoKα","","0.0571","0.0399","","","0.0724","0.0797","","","","","","1.04","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079233","8.7385","0.0009","11.4473","0.0012","15.1957","0.0016","90","","90","","90","","1520.1","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H21 N O5 -","- C16 H21 N O5 -","- C64 H84 N4 O20 -","4","1","","García-López, José-Antonio; Oliva-Madrid, María-José; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Reactivity toward CO of Eight-Membered Palladacycles Derived from the Insertion of Alkenes into the Pd‒C Bond of Cyclopalladated Primary Arylalkylamines of Pharmaceutical Interest. Synthesis of Tetrahydrobenzazocinones, Ortho-Functionalized Phenethylamines, Ureas, and an Isocyanate","Organometallics","2012","31","17","6351","","10.1021/om300593x","","","0.71073","MoKα","","0.0492","0.0466","","","0.1197","0.1214","","","","","","1.142","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079234","16.1586","0.0008","8.8804","0.0004","20.4565","0.0011","90","","90","","90","","2935.4","0.3","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C16 H21 N O3 -","- C16 H21 N O3 -","- C128 H168 N8 O24 -","8","2","","García-López, José-Antonio; Oliva-Madrid, María-José; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Reactivity toward CO of Eight-Membered Palladacycles Derived from the Insertion of Alkenes into the Pd‒C Bond of Cyclopalladated Primary Arylalkylamines of Pharmaceutical Interest. Synthesis of Tetrahydrobenzazocinones, Ortho-Functionalized Phenethylamines, Ureas, and an Isocyanate","Organometallics","2012","31","17","6351","","10.1021/om300593x","","","0.71073","MoKα","","0.0455","0.0432","","","0.1054","0.1068","","","","","","1.042","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079235","7.0248","0.0009","14.0118","0.0018","13.121","0.0017","90","","90.498","0.002","90","","1291.5","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 N O2 -","- C15 H19 N O2 -","- C60 H76 N4 O8 -","4","1","","García-López, José-Antonio; Oliva-Madrid, María-José; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Reactivity toward CO of Eight-Membered Palladacycles Derived from the Insertion of Alkenes into the Pd‒C Bond of Cyclopalladated Primary Arylalkylamines of Pharmaceutical Interest. Synthesis of Tetrahydrobenzazocinones, Ortho-Functionalized Phenethylamines, Ureas, and an Isocyanate","Organometallics","2012","31","17","6351","","10.1021/om300593x","","","0.71073","MoKα","","0.0658","0.0519","","","0.1144","0.1215","","","","","","1.062","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079236","8.3839","0.0003","9.2671","0.0004","37.1174","0.0015","90","","90","","90","","2883.8","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H22 Cl N O -","- C14 H22 Cl N O -","- C112 H176 Cl8 N8 O8 -","8","1","","García-López, José-Antonio; Oliva-Madrid, María-José; Saura-Llamas, Isabel; Bautista, Delia; Vicente, José","Reactivity toward CO of Eight-Membered Palladacycles Derived from the Insertion of Alkenes into the Pd–C Bond of Cyclopalladated Primary Arylalkylamines of Pharmaceutical Interest. Synthesis of Tetrahydrobenzazocinones, Ortho-Functionalized Phenethylamines, Ureas, and an Isocyanate","Organometallics","2012","31","17","6351","","10.1021/om300593x","","","0.71073","MoKα","","0.0536","0.0461","","","0.1072","0.1117","","","","","","1.121","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079237","7.7944","0.0002","9.9168","0.0003","19.1033","0.0005","90","","95.0725","0.0003","90","","1470.82","0.07","283","2","283","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Au Cl3 N2 -","- C12 H12 Au Cl3 N2 -","- C48 H48 Au4 Cl12 N8 -","4","1","","Shaw, Anthony P.; Ghosh, Manik Kumer; Törnroos, Karl W.; Wragg, David S.; Tilset, Mats; Swang, Ole; Heyn, Richard H.; Jakobsen, Søren","Rock ‘n’ Roll With Gold: Synthesis, Structure, and Dynamics of a (bipyridine)AuCl3Complex","Organometallics","2012","31","20","7093","","10.1021/om300594c","","","0.71073","MoKα","","0.0192","0.0176","","","0.046","0.0469","","","","","","1.055","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079238","11.8067","0.0011","10.9333","0.001","12.8322","0.0012","90","","101.971","0.001","90","","1620.4","0.3","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Au Cl3 N2 -","- C14 H16 Au Cl3 N2 -","- C56 H64 Au4 Cl12 N8 -","4","1","","Shaw, Anthony P.; Ghosh, Manik Kumer; Törnroos, Karl W.; Wragg, David S.; Tilset, Mats; Swang, Ole; Heyn, Richard H.; Jakobsen, Søren","Rock ‘n’ Roll With Gold: Synthesis, Structure, and Dynamics of a (bipyridine)AuCl3Complex","Organometallics","2012","31","20","7093","","10.1021/om300594c","","","0.71073","MoKα","","0.0148","0.0143","","","0.0373","0.0377","","","","","","1.114","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079239","12.8112","0.0004","20.0725","0.001","19.3187","0.0007","90","","108.278","0.002","90","","4717.2","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H48 F6 P4 Ru -","- C48 H48 F6 P4 Ru -","- C192 H192 F24 P16 Ru4 -","4","1","","Sues, Peter E.; Lough, Alan J.; Morris, Robert H.","Flexible Syntheses of Tripodal Phosphine Ligands 1,1,2-Tris(diarylphosphino)ethane and Their Ruthenium η5-C5Me5Complexes","Organometallics","2012","31","18","6589","","10.1021/om3005959","","","0.71073","MoKα","","0.152","0.0687","","","0.1625","0.1983","","","","","","0.949","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079240","16.533","0.002","20.395","0.002","16.872","0.002","90","","92.901","0.003","90","","5681.8","1.1","150","2","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H64 Cl4 F6 P4 Ru -","- C56 H64 Cl4 F6 P4 Ru -","- C224 H256 Cl16 F24 P16 Ru4 -","4","1","","Sues, Peter E.; Lough, Alan J.; Morris, Robert H.","Flexible Syntheses of Tripodal Phosphine Ligands 1,1,2-Tris(diarylphosphino)ethane and Their Ruthenium η5-C5Me5Complexes","Organometallics","2012","31","18","6589","","10.1021/om3005959","","","0.71073","MoKα","","0.0482","0.0344","","","0.0788","0.0867","","","","","","1.02","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079241","23.246","0.003","11.5646","0.0014","39.062","0.005","90","","105.917","0.002","90","","10098","2","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54.5 H61 Cl F6 P4 Ru -","- C54.5 H61 Cl F6 P4 Ru -","- C436 H488 Cl8 F48 P32 Ru8 -","8","2","","Sues, Peter E.; Lough, Alan J.; Morris, Robert H.","Flexible Syntheses of Tripodal Phosphine Ligands 1,1,2-Tris(diarylphosphino)ethane and Their Ruthenium η5-C5Me5Complexes","Organometallics","2012","31","18","6589","","10.1021/om3005959","","","0.71073","MoKα","","0.0746","0.0483","","","0.1171","0.1256","","","","","","1.048","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079242","18.656","0.002","17.8341","0.0019","16.6525","0.0017","90","","93.02","0.002","90","","5532.8","1","147","2","147","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C60 H72 F6 P4 Ru -","- C60 H72 F6 P4 Ru -","- C240 H288 F24 P16 Ru4 -","4","1","","Sues, Peter E.; Lough, Alan J.; Morris, Robert H.","Flexible Syntheses of Tripodal Phosphine Ligands 1,1,2-Tris(diarylphosphino)ethane and Their Ruthenium η5-C5Me5Complexes","Organometallics","2012","31","18","6589","","10.1021/om3005959","","","0.71073","MoKα","","0.0335","0.0296","","","0.0629","0.0651","","","","","","1.024","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079243","8.2565","0.0002","23.3232","0.0006","9.7291","0.0002","90","","90","","90","","1873.51","0.08","115","","115","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C24 H20 Fe2 S -","- C24 H20 Fe2 S -","- C96 H80 Fe8 S4 -","4","0.5","","Speck, J. Matthäus; Claus, Ron; Hildebrandt, Alexander; Rüffer, Tobias; Erasmus, Elizabeth; van As, Lydia; Swarts, Jannie C.; Lang, Heinrich","Electron Transfer Studies on Ferrocenylthiophenes: Synthesis, Properties, and Electrochemistry","Organometallics","2012","31","17","6373","","10.1021/om3006036","","","0.71073","MoKα","","0.0347","0.0284","","","0.0652","0.068","","","","","","1.044","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079244","10.1477","0.0009","11.1863","0.0009","16.6034","0.001","93.754","0.006","95.108","0.006","112.78","0.008","1720.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H41 B Fe O4 Ru2 -","- C38 H41 B Fe O4 Ru2 -","- C76 H82 B2 Fe2 O8 Ru4 -","2","1","","Geetharani, K.; Ramkumar, V.; Ghosh, Sundargopal","Synthesis and Characterization of Novel Ruthenaferracarboranes from Photoinsertion of Alkynes into a Ruthenaferraborane","Organometallics","2012","31","17","6381","","10.1021/om300607u","","","0.71073","MoKα","","0.1214","0.1045","","","0.2502","0.2715","","","","","","1.04","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079245","10.0672","0.0003","17.0051","0.0004","20.5756","0.0005","90","","97.353","0.001","90","","3493.45","0.16","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H39 B2 Fe2 O6 Ru2 -","- C35 H39 B2 Fe2 O6 Ru2 -","- C140 H156 B8 Fe8 O24 Ru8 -","4","1","","Geetharani, K.; Ramkumar, V.; Ghosh, Sundargopal","Synthesis and Characterization of Novel Ruthenaferracarboranes from Photoinsertion of Alkynes into a Ruthenaferraborane","Organometallics","2012","31","17","6381","","10.1021/om300607u","","","0.71073","MoKα","","0.0317","0.0255","","","0.0618","0.0659","","","","","","1.065","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079246","9.7112","0.0005","18.7378","0.0008","17.9279","0.0007","90","","105.515","0.002","90","","3143.4","0.2","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H37 B2 Fe2 O6 Ru2 -","- C30 H37 B2 Fe2 O6 Ru2 -","- C120 H148 B8 Fe8 O24 Ru8 -","4","1","","Geetharani, K.; Ramkumar, V.; Ghosh, Sundargopal","Synthesis and Characterization of Novel Ruthenaferracarboranes from Photoinsertion of Alkynes into a Ruthenaferraborane","Organometallics","2012","31","17","6381","","10.1021/om300607u","","","0.71073","MoKα","","0.0545","0.0391","","","0.1142","0.1271","","","","","","0.878","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079247","12.4637","0.0003","15.0424","0.0003","22.1121","0.0004","90","","93.363","0.001","90","","4138.52","0.15","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H47 B2 Fe2 O5 P Ru2 -","- C45 H47 B2 Fe2 O5 P Ru2 -","- C180 H188 B8 Fe8 O20 P4 Ru8 -","4","1","","Geetharani, K.; Ramkumar, V.; Ghosh, Sundargopal","Synthesis and Characterization of Novel Ruthenaferracarboranes from Photoinsertion of Alkynes into a Ruthenaferraborane","Organometallics","2012","31","17","6381","","10.1021/om300607u","","","0.71073","MoKα","","0.0915","0.0413","","","0.1048","0.1383","","","","","","0.785","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079248","9.3422","0.0005","9.4522","0.0005","10.264","0.0005","66.577","0.002","68.908","0.002","64.231","0.002","729.52","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Complex_5.HBr","","","- C18 H26 Ag2 Br4 N8 S2 -","- C18 H26 Ag2 Br4 N8 S2 -","- C18 H26 Ag2 Br4 N8 S2 -","1","0.5","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0193","0.0173","","","0.0399","0.0409","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079249","12.4284","0.0007","11.4574","0.0006","15.0842","0.0008","90","","107.529","0.002","90","","2048.21","0.19","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex_6","","","- C42 H40 Ag2 Br2 N8 S2 -","- C42 H40 Ag2 Br2 N8 S2 -","- C84 H80 Ag4 Br4 N16 S4 -","2","0.5","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0405","0.0305","","","0.071","0.0761","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079250","8.2063","0.0007","35.516","0.003","37.039","0.003","90","","90","","90","","10795.2","1.6","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","Complex_9","","","- C18 H24 Br2 N8 Pd S2 -","- C18 H24 Br2 N8 Pd S2 -","- C288 H384 Br32 N128 Pd16 S32 -","16","0.5","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0795","0.0602","","","0.1141","0.1192","","","","","","1.136","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079251","13.0646","0.0011","26.493","0.002","14.1483","0.0012","90","","109.983","0.001","90","","4602.2","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Complex_12","","","- C46 H46 Br2 N10 Pd S2 -","- C46 H46 Br2 N10 Pd S2 -","- C184 H184 Br8 N40 Pd4 S8 -","4","1","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0367","0.0296","","","0.072","0.0753","","","","","","1.04","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079252","20.408","0.003","10.2059","0.0012","18.247","0.002","90","","107.452","0.004","90","","3625.6","0.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Complex_15","","","- C11 H15 Br2 N5 Pd S -","- C11 H15 Br2 N5 Pd S -","- C88 H120 Br16 N40 Pd8 S8 -","8","1","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","1.54178","CuKα","","0.0346","0.0312","","","0.0828","0.0853","","","","","","1.055","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079253","8.6869","0.0004","25.5179","0.0013","10.3296","0.0005","90","","96.97","0.002","90","","2272.86","0.19","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 Br2 N4 Pd S -","- C21 H20 Br2 N4 Pd S -","- C84 H80 Br8 N16 Pd4 S4 -","4","1","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0367","0.0257","","","0.0514","0.0544","","","","","","1.034","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079254","35.5377","0.0014","13.3056","0.0005","16.5435","0.0006","90","","105.493","0.002","90","","7538.4","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Complex_17","","","- C37 H39 Br2 N5 P2 Pd S -","- C37 H39 Br2 N5 P2 Pd S -","- C296 H312 Br16 N40 P16 Pd8 S8 -","8","1","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0956","0.0549","","","0.1029","0.1165","","","","","","1.028","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079255","10.8354","0.0001","17.0901","0.0002","22.6158","0.0003","90","","99.121","0.001","90","","4135","0.08","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","Complex_20","","","- C38.65 H41.97 Br0.68 N4 O2.65 P2 Pd S -","- C38.6474 H41.9711 Br0.6763 N4 O2.6474 P2 Pd S -","- C154.59 H167.884 Br2.7052 N16 O10.5896 P8 Pd4 S4 -","4","1","","Slivarichova, Miriam; Reading, Eamonn; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.","Silver and Palladium Complexes Containing Ditopic N-Heterocyclic Carbene‒Thione Ligands","Organometallics","2012","31","18","6595","","10.1021/om300615e","","","0.71073","MoKα","","0.0336","0.0291","","","0.0693","0.0712","","","","","","1.044","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079256","7.271","0.003","17.379","0.008","30.265","0.013","90","","95.533","0.008","90","","3807","3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 N2 O9 Pt -","- C12 H18 N2 O9 Pt -","- C96 H144 N16 O72 Pt8 -","8","2","","Pellarin, Kyle R.; McCready, Matthew S.; Puddephatt, Richard J.","Oxidation of Dimethylplatinum(II) Complexes with a Dioxirane: The Viability of Oxoplatinum(IV) Intermediates","Organometallics","2012","31","17","6388","","10.1021/om300616x","","","0.71073","MoKα","","0.0647","0.0429","","","0.0825","0.0896","","","","","","1.024","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079257","20.922","0.007","15.856","0.004","16.935","0.006","90","","101.106","0.008","90","","5513","3","93","2","93","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C56 H76 B Cu F4 N4 O2 -","- C56 H76 B Cu F4 N4 O2 -","- C224 H304 B4 Cu4 F16 N16 O8 -","4","0.5","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.0945","0.0621","","","0.1766","0.2125","","","","","","0.807","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079258","11.102","0.002","20.559","0.004","21.897","0.004","90","","97.252","0.006","90","","4957.9","1.6","93","2","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H70 B Cu F4 N4 O -","- C52 H70 B Cu F4 N4 O -","- C208 H280 B4 Cu4 F16 N16 O4 -","4","1","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.1281","0.0724","","","0.1896","0.2389","","","","","","1.061","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079259","20.475","0.005","15.838","0.004","13.143","0.003","90","","90","","90","","4262.1","1.8","93","2","93","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C42 H60 B Cu F4 N4 -","- C42 H60 B Cu F4 N4 -","- C168 H240 B4 Cu4 F16 N16 -","4","0.25","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.0679","0.0557","","","0.1495","0.1616","","","","","","0.793","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079260","23.477","0.004","14.538","0.003","22.655","0.005","90","","90","","90","","7732","3","93","2","93","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C38 H56 B Cu F4 N4 -","- C38 H56 B Cu F4 N4 -","- C304 H448 B8 Cu8 F32 N32 -","8","2","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.1108","0.0633","","","0.1146","0.1324","","","","","","0.991","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079261","24.371","0.004","25.234","0.004","31.185","0.005","90","","90","","90","","19178","5","93","2","93","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C50 H66 B Cu F4 N4 -","- C50 H66 B Cu F4 N4 -","- C800 H1056 B16 Cu16 F64 N64 -","16","0.5","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.1212","0.0813","","","0.2426","0.2803","","","","","","1.038","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079262","20.654","0.005","21.449","0.004","20.277","0.005","90","","114.94","0.006","90","","8145","3","93","2","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H63 B Cu F4 N2 P -","- C39 H63 B Cu F4 N2 P -","- C312 H504 B8 Cu8 F32 N16 P8 -","8","2","","Lazreg, Faïma; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Heteroleptic Bis(N-heterocyclic carbene)Copper(I) Complexes: Highly Efficient Systems for the [3+2] Cycloaddition of Azides and Alkynes","Organometallics","2012","31","22","7969","","10.1021/om3006195","","","0.71073","MoKα","","0.1262","0.0933","","","0.264","0.2975","","","","","","1.003","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079263","12.4343","0.0003","28.1257","0.0005","15.6486","0.0003","90","","101.69","0.002","90","","5359.17","0.19","133","2","133","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C55 H55 Cl4 N O8 P2 Ru -","- C55 H55 Cl4 N O8 P2 Ru -","- C220 H220 Cl16 N4 O32 P8 Ru4 -","4","1","","Xiang, Jing; Lo, Larry Tso-Lun; Leung, Chi-Fai; Yiu, Shek-Man; Ko, Chi-Chiu; Lau, Tai-Chu","Synthesis, Structures, and Photophysical Properties of Ruthenium(II) Quinolinolato Complexes","Organometallics","2012","31","20","7101","","10.1021/om300621x","","","1.54184","CUKα","","0.0529","0.0482","","","0.1364","0.1386","","","","","","1.119","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079264","9.2381","0.0003","12.5884","0.0004","17.4284","0.0005","82.761","0.002","86.015","0.003","74.412","0.003","1935.34","0.11","173","2","173","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H41 N O2 P2 Ru -","- C48 H41 N O2 P2 Ru -","- C96 H82 N2 O4 P4 Ru2 -","2","1","","Xiang, Jing; Lo, Larry Tso-Lun; Leung, Chi-Fai; Yiu, Shek-Man; Ko, Chi-Chiu; Lau, Tai-Chu","Synthesis, Structures, and Photophysical Properties of Ruthenium(II) Quinolinolato Complexes","Organometallics","2012","31","20","7101","","10.1021/om300621x","","","1.5418","CuKα","","0.0381","0.0337","","","0.1172","0.1181","","","","","","1.227","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079265","12.5278","0.0005","13.1009","0.0005","16.4148","0.0005","101.879","0.003","92.797","0.003","111","0.003","2439.03","0.17","133","2","133","","","","","","","","","7","P -1","-P 1","2","","","","- C55.25 H45.5 Cl0.5 N3 O3 P2 Ru -","- C55.25 H43 Cl0.5 N3 O3 P2 Ru -","- C110.5 H86 Cl N6 O6 P4 Ru2 -","2","1","","Xiang, Jing; Lo, Larry Tso-Lun; Leung, Chi-Fai; Yiu, Shek-Man; Ko, Chi-Chiu; Lau, Tai-Chu","Synthesis, Structures, and Photophysical Properties of Ruthenium(II) Quinolinolato Complexes","Organometallics","2012","31","20","7101","","10.1021/om300621x","","","1.5418","CuKα","","0.038","0.036","","","0.1071","0.108","","","","","","1.081","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079266","12.4298","0.0003","24.7828","0.0006","13.3653","0.0003","90","","94.183","0.002","90","","4106.15","0.17","133","2","133","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H45 F6 N3 O2 P2 Ru -","- C43 H45 F6 N3 O2 P2 Ru -","- C172 H180 F24 N12 O8 P8 Ru4 -","4","1","","Xiang, Jing; Lo, Larry Tso-Lun; Leung, Chi-Fai; Yiu, Shek-Man; Ko, Chi-Chiu; Lau, Tai-Chu","Synthesis, Structures, and Photophysical Properties of Ruthenium(II) Quinolinolato Complexes","Organometallics","2012","31","20","7101","","10.1021/om300621x","","","1.5418","CuKα","","0.0428","0.0395","","","0.0972","0.0989","","","","","","1.03","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079267","9.884","0.0006","12.5542","0.0007","18.2476","0.001","94.033","0.001","90.052","0.001","100.017","0.001","2224","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H45 Cl2 I O2 P2 Rh2 S2 -","- C46 H45 Cl2 I O2 P2 Rh2 S2 -","- C92 H90 Cl4 I2 O4 P4 Rh4 S4 -","2","1","","Nguyen, Duc Hanh; Modrego, F. Javier; Cetina-Casas, J. Miguel; Gómez-Bautista, Daniel; Jiménez, M. Victoria; Castarlenas, Ricardo; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","Steric Effects in the Oxidative Addition of MeI to a Sulfido-Bridged ZrRh2Early‒Late Heterobimetallic Compound","Organometallics","2012","31","17","6395","","10.1021/om300629k","","","0.71073","MoKα","","0.0496","0.0376","","","0.0873","0.0924","","","","","","1.032","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079268","21.766","0.0019","10.8346","0.0009","23.806","0.002","90","","150.061","0.001","90","","2801.9","0.4","100","2","100","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C55 H50 Cl6 I2 O P2 Rh2 S2 -","- C55 H50 Cl6 I2 O P2 Rh2 S2 -","- C110 H100 Cl12 I4 O2 P4 Rh4 S4 -","2","0.5","","Nguyen, Duc Hanh; Modrego, F. Javier; Cetina-Casas, J. Miguel; Gómez-Bautista, Daniel; Jiménez, M. Victoria; Castarlenas, Ricardo; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","Steric Effects in the Oxidative Addition of MeI to a Sulfido-Bridged ZrRh2Early‒Late Heterobimetallic Compound","Organometallics","2012","31","17","6395","","10.1021/om300629k","","","0.71073","MoKα","","0.0772","0.0504","","","0.1134","0.1238","","","","","","1.027","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079269","12.0753","0.0008","15.6227","0.001","19.1582","0.0012","69.1874","0.0041","85.5499","0.0041","87.088","0.004","3367.1","0.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C40.5 H31 Cl Fe O4 P2 -","- C40.499 H30.998 Cl0.998 Fe O4 P2 -","- C161.996 H123.992 Cl3.992 Fe4 O16 P8 -","4","2","","Lei, Hao; Royer, Aaron M.; Rauchfuss, Thomas B.; Gray, Danielle","C2-Symmetric Iron(II) Diphosphine‒Dialkoxide Dicarbonyl and Related Complexes","Organometallics","2012","31","17","6408","","10.1021/om300631a","","","0.71073","MoKα","","0.0864","0.0462","","","0.0887","0.1017","","","","","","0.994","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079270","13.145","0.0008","12.2586","0.0008","20.1642","0.0013","90","","100.996","0.005","90","","3189.6","0.4","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H30 Fe O3 P2 -","- C39 H30 Fe O3 P2 -","- C156 H120 Fe4 O12 P8 -","4","1","","Lei, Hao; Royer, Aaron M.; Rauchfuss, Thomas B.; Gray, Danielle","C2-Symmetric Iron(II) Diphosphine‒Dialkoxide Dicarbonyl and Related Complexes","Organometallics","2012","31","17","6408","","10.1021/om300631a","","","1.54178","CuKα","","0.0693","0.0472","","","0.1144","0.1254","","","","","","1.019","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079271","16.6352","0.0007","12.8715","0.0005","17.8274","0.0008","90","","93.907","0.002","90","","3808.3","0.3","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H34 Cl Fe N O3 P2 -","- C46 H34 Cl Fe N O3 P2 -","- C184 H136 Cl4 Fe4 N4 O12 P8 -","4","1","","Lei, Hao; Royer, Aaron M.; Rauchfuss, Thomas B.; Gray, Danielle","C2-Symmetric Iron(II) Diphosphine‒Dialkoxide Dicarbonyl and Related Complexes","Organometallics","2012","31","17","6408","","10.1021/om300631a","","","1.54178","CuKα","","0.0384","0.0342","","","0.0859","0.0885","","","","","","1.028","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079272","11.9085","0.0008","12.9178","0.0009","15.5436","0.001","67.817","0.003","76.915","0.004","83.142","0.004","2155.1","0.3","193","2","193","2","","","","","","","","9","P -1","-P 1","2","","","","- C42 H28 B2 Cl4 D6 F6 Fe O4 P2 -","- C42 H34 B2 Cl4 F6 Fe O4 P2 -","- C84 H68 B4 Cl8 F12 Fe2 O8 P4 -","2","1","","Lei, Hao; Royer, Aaron M.; Rauchfuss, Thomas B.; Gray, Danielle","C2-Symmetric Iron(II) Diphosphine‒Dialkoxide Dicarbonyl and Related Complexes","Organometallics","2012","31","17","6408","","10.1021/om300631a","","","0.71073","MoKα","","0.0704","0.0573","","","0.1561","0.1669","","","","","","1.07","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079273","7.9701","0.0016","13.576","0.003","13.316","0.003","90","","96.49","0.008","90","","1431.6","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 O4 Pd S3 -","- C10 H18 O4 Pd S3 -","- C40 H72 O16 Pd4 S12 -","4","1","","Lee, John P.; Keller, C. Luke; Werlein, Ashley A.; Janzen, Daron E.; VanDerveer, Donald G.; Grant, Gregory J.","C‒H Bond Activation by a Palladium(II) Thioether Complex: Formation of the Bis(nitromethanate) Complex [Pd(9S3)(CH2NO2)2]","Organometallics","2012","31","18","6505","","10.1021/om3006382","","","0.71073","MoKα","","0.1316","0.0853","","","0.199","0.2519","","","","","","1.056","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079274","7.8595","0.0016","9.904","0.002","18.205","0.004","90","","95.96","0.03","90","","1409.4","0.5","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H16 N2 O4 Pd S3 -","- C8 H16 N2 O4 Pd S3 -","- C32 H64 N8 O16 Pd4 S12 -","4","1","","Lee, John P.; Keller, C. Luke; Werlein, Ashley A.; Janzen, Daron E.; VanDerveer, Donald G.; Grant, Gregory J.","C‒H Bond Activation by a Palladium(II) Thioether Complex: Formation of the Bis(nitromethanate) Complex [Pd(9S3)(CH2NO2)2]","Organometallics","2012","31","18","6505","","10.1021/om3006382","","","0.71073","MoKα","","0.0478","0.0405","","","0.0779","0.0804","","","","","","1.167","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079275","18.996","0.005","19.838","0.006","18.726","0.004","90","","29.008","0.007","90","","3422","1.7","113.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C45 H38 P Rh -","- C45 H38 P Rh -","- C180 H152 P4 Rh4 -","4","1","","Kumazawa, Shohei; Rodriguez Castanon, Jesus; Onishi, Naoya; Kuwata, Keiko; Shiotsuki, Masashi; Sanda, Fumio","Characterization of the Polymerization Catalyst [(2,5-norbornadiene)Rh{C(Ph)═CPh2}(PPh3)] and Identification of the End Structures of Poly(phenylacetylenes) Obtained by Polymerization Using This Catalyst","Organometallics","2012","31","19","6834","","10.1021/om300642b","","","0.71075","MoKα","","","0.0662","","","","0.067","","","","","","1.092","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079276","10.861","0.0015","12.0263","0.0019","36.135","0.003","90","","92.301","0.001","90","","4716.1","1.1","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H33 Cl F18 N13 P3 Ru2 -","- C32 H33 Cl F18 N13 P3 Ru2 -","- C128 H132 Cl4 F72 N52 P12 Ru8 -","4","1","","Liu, Xiaolong; Chen, Wanzhi","Pyridazine-Based N-Heterocyclic Carbene Complexes and Ruthenium-Catalyzed Oxidation Reaction of Alkenes","Organometallics","2012","31","18","6614","","10.1021/om300644h","","","0.71073","MoKα","","0.1047","0.0543","","","0.106","0.1331","","","","","","1.065","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079277","20.2458","0.0019","20.2458","0.0019","20.2458","0.0019","90","","90","","90","","8298.6","1.3","293","2","293","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","","","- C66 H54 Cu3 F18 N24 O3 P3 -","- C66 H54 Cu3 F18 N24 O3 P3 -","- C264 H216 Cu12 F72 N96 O12 P12 -","4","0.333333","","Liu, Xiaolong; Chen, Wanzhi","Pyridazine-Based N-Heterocyclic Carbene Complexes and Ruthenium-Catalyzed Oxidation Reaction of Alkenes","Organometallics","2012","31","18","6614","","10.1021/om300644h","","","0.71073","MoKα","","0.092","0.066","","","0.168","0.1823","","","","","","0.922","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079278","14.4781","0.0008","15.6757","0.0008","15.4845","0.0008","90","","90","","90","","3514.3","0.3","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C28 H28 F12 N8 P2 Pd2 -","- C28 H28 F12 N8 P2 Pd2 -","- C112 H112 F48 N32 P8 Pd8 -","4","0.5","","Liu, Xiaolong; Chen, Wanzhi","Pyridazine-Based N-Heterocyclic Carbene Complexes and Ruthenium-Catalyzed Oxidation Reaction of Alkenes","Organometallics","2012","31","18","6614","","10.1021/om300644h","","","0.71073","MoKα","","0.0945","0.0734","","","0.2021","0.2233","","","","","","1.11","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079279","8.9307","0.0002","14.168","0.0003","14.3697","0.0003","90","","100.477","0.002","90","","1787.89","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 F12 N8 P2 Pd2 -","- C28 H34 F12 N8 P2 Pd2 -","- C56 H68 F24 N16 P4 Pd4 -","2","0.5","","Liu, Xiaolong; Chen, Wanzhi","Pyridazine-Based N-Heterocyclic Carbene Complexes and Ruthenium-Catalyzed Oxidation Reaction of Alkenes","Organometallics","2012","31","18","6614","","10.1021/om300644h","","","0.71073","MoKα","","0.0447","0.0382","","","0.1005","0.1064","","","","","","1.043","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079280","20.0236","0.0009","13.0568","0.0006","15.1251","0.001","90","","97.998","0.005","90","","3915.9","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 F12 N11 Ni O2 P2 -","- C30 H29 F12 N11 Ni O2 P2 -","- C120 H116 F48 N44 Ni4 O8 P8 -","4","1","","Liu, Xiaolong; Chen, Wanzhi","Pyridazine-Based N-Heterocyclic Carbene Complexes and Ruthenium-Catalyzed Oxidation Reaction of Alkenes","Organometallics","2012","31","18","6614","","10.1021/om300644h","","","0.71073","MoKα","","0.0899","0.0658","","","0.1806","0.2032","","","","","","1.037","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079281","9.2685","0.0016","9.6887","0.0017","14.218","0.003","109.083","0.002","100.883","0.003","97.698","0.002","1158.3","0.4","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","LG-65-B","","","- C22 H22 Cl Mn N4 O6 -","- C22 H22 Cl Mn N4 O6 -","- C44 H44 Cl2 Mn2 N8 O12 -","2","1","","Ruiz, Javier; Garc\?ía, Lucía; Mejuto, Carmen; Perandones, Bernabé F.; Vivanco, Marilín","Divergent Reactivity of Mixed-Ligand Manganese(I) Carbonyl‒Isocyanide Complexes toward Primary Amines","Organometallics","2012","31","17","6420","","10.1021/om3006454","","x-ray","0.71073","MoKα","","0.0684","0.0461","","","0.1106","0.1217","","","","","","1.021","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079282","8.6205","0.0008","10.2963","0.0013","14.1706","0.0015","85.667","0.005","81.03","0.004","65.265","0.003","1128.3","0.2","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C23 H20 Cl Mn N4 O7 -","- C23 H20 Cl Mn N4 O7 -","- C46 H40 Cl2 Mn2 N8 O14 -","2","1","","Ruiz, Javier; Garc\?ía, Lucía; Mejuto, Carmen; Perandones, Bernabé F.; Vivanco, Marilín","Divergent Reactivity of Mixed-Ligand Manganese(I) Carbonyl‒Isocyanide Complexes toward Primary Amines","Organometallics","2012","31","17","6420","","10.1021/om3006454","","x-ray","0.7107","MoKα","","0.0502","0.0376","","","0.0929","0.1003","","","","","","1.063","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079283","12.5473","0.0011","12.5952","0.001","15.1387","0.0014","90","","113.91","0.004","90","","2187.1","0.3","100","2","100","2","","","","","","","synthesis as described","7","P 1 21/m 1","-P 2yb","11","","","","- C19 H18 F3 Mn N4 O6 S -","- C19 H18 F3 Mn N4 O6 S -","- C76 H72 F12 Mn4 N16 O24 S4 -","4","1","","Ruiz, Javier; Garc\?ía, Lucía; Mejuto, Carmen; Perandones, Bernabé F.; Vivanco, Marilín","Divergent Reactivity of Mixed-Ligand Manganese(I) Carbonyl‒Isocyanide Complexes toward Primary Amines","Organometallics","2012","31","17","6420","","10.1021/om3006454","","x-ray","0.7107","MoKα","","0.094","0.0709","","","0.1288","0.1384","","","","","","1.066","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079284","8.2585","0.0006","10.0327","0.0007","15.4922","0.0011","88.948","0.004","88.022","0.004","73.555","0.004","1230.31","0.15","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C25 H24 Br Mn N4 O3 -","- C25 H24 Br Mn N4 O3 -","- C50 H48 Br2 Mn2 N8 O6 -","2","1","","Ruiz, Javier; Garc\?ía, Lucía; Mejuto, Carmen; Perandones, Bernabé F.; Vivanco, Marilín","Divergent Reactivity of Mixed-Ligand Manganese(I) Carbonyl‒Isocyanide Complexes toward Primary Amines","Organometallics","2012","31","17","6420","","10.1021/om3006454","","x-ray","0.7107","MoKα","","0.0892","0.0529","","","0.1223","0.1395","","","","","","1.035","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079285","8.8447","0.0002","16.2398","0.0004","12.1115","0.0003","90","","97.241","0.001","90","","1725.78","0.07","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 Cl N2 Sn -","- C16 H23 Cl N2 Sn -","- C64 H92 Cl4 N8 Sn4 -","4","1","","Chia, Siew-Peng; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Reactivity of a Distannylene toward Potassium Graphite: Synthesis of a Stannylidenide Anion","Organometallics","2012","31","17","6415","","10.1021/om300646d","","","0.71073","MoKα","","0.0642","0.0492","","","0.1471","0.1564","","","","","","1.036","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079286","18.2275","0.0005","17.1965","0.0005","20.7428","0.0007","90","","90","","90","","6501.8","0.3","103","2","103","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H46 N4 Sn2 -","- C32 H46 N4 Sn2 -","- C256 H368 N32 Sn16 -","8","1","","Chia, Siew-Peng; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Reactivity of a Distannylene toward Potassium Graphite: Synthesis of a Stannylidenide Anion","Organometallics","2012","31","17","6415","","10.1021/om300646d","","","0.71073","MoKα","","0.071","0.0368","","","0.0949","0.1353","","","","","","1.057","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079287","10.2822","0.0005","11.0911","0.0005","20.2384","0.0012","90","","90","","90","","2308","0.2","103","2","103","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H31 K N2 O Sn -","- C20 H31 K N2 O Sn -","- C80 H124 K4 N8 O4 Sn4 -","4","1","","Chia, Siew-Peng; Ganguly, Rakesh; Li, Yongxin; So, Cheuk-Wai","Reactivity of a Distannylene toward Potassium Graphite: Synthesis of a Stannylidenide Anion","Organometallics","2012","31","17","6415","","10.1021/om300646d","","","0.71073","MoKα","","0.0826","0.0515","","","0.1055","0.1336","","","","","","1.01","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079288","10.326","0.0002","14.5123","0.0002","15.9712","0.0002","90","","97.268","0.001","90","","2374.12","0.06","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H13 N3 O8 Ru3 -","- C22 H13 N3 O8 Ru3 -","- C88 H52 N12 O32 Ru12 -","4","1","","Cabeza, Javier A.; Damonte, Marina; Pérez-Carre Enrique","Reactivity of a Quinoline-Tethered N-Heterocyclic Carbene with Polynuclear Ruthenium Carbonyls","Organometallics","2012","31","23","8114","","10.1021/om300651d","","","1.5418","CuKα","","0.0369","0.0279","","","0.0647","0.0695","","","","","","1.018","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079289","26.705","0.004","19.098","0.003","18.507","0.003","90","","95.03","0.002","90","","9402","3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C90 H220 I12 K6 O36 Si24 Zn6 -","- C90 H220 I12 K6 O36 Si24 Zn6 -","- C180 H440 I24 K12 O72 Si48 Zn12 -","2","0.5","","Li, Hui; Hung-Low, Fernando; Krempner, Clemens","Synthesis and Structure of Zwitterionic Silylborates and Silylzincates with Pendant Polydonor Arms","Organometallics","2012","31","20","7117","","10.1021/om300652n","","","0.71073","MoKα","","0.0832","0.0589","","","0.1387","0.1527","","","","","","1.027","","","","has coordinates,has disorder","178681","2020-10-21","18:00:00",""
"4079290","10.627","0.002","13.144","0.003","16.759","0.003","85.465","0.001","89.522","0.002","68.743","0.002","2174.3","0.8","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H39 B F15 K O6 Si4 -","- C33 H39 B F15 K O6 Si4 -","- C66 H78 B2 F30 K2 O12 Si8 -","2","1","","Li, Hui; Hung-Low, Fernando; Krempner, Clemens","Synthesis and Structure of Zwitterionic Silylborates and Silylzincates with Pendant Polydonor Arms","Organometallics","2012","31","20","7117","","10.1021/om300652n","","","0.71073","MoKα","","0.0912","0.0466","","","0.0937","0.1086","","","","","","0.99","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079291","13.074","0.004","23.738","0.007","20.501","0.006","90","","106.964","0.002","90","","6086","3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H42 B2 F30 O6 Si4 Zn -","- C52 H42 B2 F30 O6 Si4 Zn -","- C208 H168 B8 F120 O24 Si16 Zn4 -","4","1","","Li, Hui; Hung-Low, Fernando; Krempner, Clemens","Synthesis and Structure of Zwitterionic Silylborates and Silylzincates with Pendant Polydonor Arms","Organometallics","2012","31","20","7117","","10.1021/om300652n","","","0.71073","MoKα","","0.0505","0.0322","","","0.0673","0.0747","","","","","","1.015","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079292","13.932","0.004","18.058","0.006","16.132","0.005","90","","107.75","0.018","90","","3865","2","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H22 F20 N10 Re2 -","- C34 H22 F20 N10 Re2 -","- C136 H88 F80 N40 Re8 -","4","1","","Smeltz, Jessica L.; Boyle, Paul D.; Ison, Elon A.","Role of Low-Valent Rhenium Species in Catalytic Hydrosilylation Reactions with Oxorhenium Catalysts","Organometallics","2012","31","17","5994","","10.1021/om300654q","","","0.71073","MoKα","","0.0713","0.0338","","","0.05","0.0571","","","","","","0.998","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079293","14.0323","0.0008","18.1028","0.0011","16.0862","0.001","90","","108.979","0.003","90","","3864.1","0.4","110","","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H22 F20 N6 O2 Re2 -","- C36 H22 F20 N6 O2 Re2 -","- C144 H88 F80 N24 O8 Re8 -","4","1","","Smeltz, Jessica L.; Boyle, Paul D.; Ison, Elon A.","Role of Low-Valent Rhenium Species in Catalytic Hydrosilylation Reactions with Oxorhenium Catalysts","Organometallics","2012","31","17","5994","","10.1021/om300654q","","","0.71073","MoKα","","0.0595","0.0333","","","0.0648","0.0725","","","","","","1.015","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079294","21.3154","0.0008","18.0984","0.0007","21.5042","0.0008","90","","119.441","0.001","90","","7224.5","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H41 Cu F6 N4 -","- C38 H41 Cu F6 N4 -","- C304 H328 Cu8 F48 N32 -","8","2","","Krylova, Valentina A.; Djurovich, Peter I.; Aronson, Jacob W.; Haiges, Ralf; Whited, Matthew T.; Thompson, Mark E.","Structural and Photophysical Studies of Phosphorescent Three-Coordinate Copper(I) Complexes Supported by an N-Heterocyclic Carbene Ligand","Organometallics","2012","31","22","7983","","10.1021/om300656v","","","0.71073","MoKα","","0.0482","0.0331","","","0.0835","0.0923","","","","","","1.011","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079295","11.8209","0.0011","14.4304","0.0014","20.0438","0.0018","90","","104.402","0.002","90","","3311.6","0.5","128","2","128","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H41 Cu F3 N5 -","- C36 H41 Cu F3 N5 -","- C144 H164 Cu4 F12 N20 -","4","1","","Krylova, Valentina A.; Djurovich, Peter I.; Aronson, Jacob W.; Haiges, Ralf; Whited, Matthew T.; Thompson, Mark E.","Structural and Photophysical Studies of Phosphorescent Three-Coordinate Copper(I) Complexes Supported by an N-Heterocyclic Carbene Ligand","Organometallics","2012","31","22","7983","","10.1021/om300656v","","","0.71073","MoKα","","0.0736","0.05","","","0.0742","0.0789","","","","","","1.447","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079296","11.8747","0.0002","14.5369","0.0003","19.6509","0.0004","90","","104.921","0.001","90","","3277.79","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(IPr)Cu(tpta)","","","- C35 H40 Cu F3 N6 -","- C35 H40 Cu F3 N6 -","- C140 H160 Cu4 F12 N24 -","4","1","","Krylova, Valentina A.; Djurovich, Peter I.; Aronson, Jacob W.; Haiges, Ralf; Whited, Matthew T.; Thompson, Mark E.","Structural and Photophysical Studies of Phosphorescent Three-Coordinate Copper(I) Complexes Supported by an N-Heterocyclic Carbene Ligand","Organometallics","2012","31","22","7983","","10.1021/om300656v","","","0.71073","MoKα","","0.0549","0.0404","","","0.0933","0.1063","","","","","","1.066","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079297","27.15","0.004","27.15","0.004","9.967","0.002","90","","90","","90","","7347","2","293","2","293","2","","","","","","","synthesis as described","4","P 42/n :2","-P 4bc","86","compound 3","","","- C43 H42 P2 Ru -","- C43 H42 P2 Ru -","- C344 H336 P16 Ru8 -","8","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.107","0.0533","","","0.1169","0.1372","","","","","","1.014","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079298","19.462","0.0004","18.6629","0.0003","30.1543","0.0005","90","","96.664","0.001","90","","10878.6","0.3","173","2","173","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C45 H40 D2 P2 Ru -","- C45 H40 D2 P2 Ru -","- C540 H480 D24 P24 Ru12 -","12","3","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","","0.71073","MoKα","","0.248","0.0825","","","0.0899","0.1196","","","","","","0.975","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079299","10.3273","0.0005","10.9844","0.0004","13.2916","0.0007","80.67","0.003","80.643","0.002","88.944","0.003","1468","0.12","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","compound 5","","","- C35 H33 Cl P2 Ru -","- C35 H33 Cl P2 Ru -","- C70 H66 Cl2 P4 Ru2 -","2","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.0802","0.0475","","","0.0822","0.0923","","","","","","1.004","","","","has coordinates","178681","2020-10-21","18:00:00",""
"4079300","9.8512","0.0002","9.9517","0.0003","17.527","0.0005","94.129","0.001","101.132","0.002","109.474","0.002","1572.14","0.08","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","compound 6","","","- C37 H37 Cl P2 Ru -","- C37 H37 Cl P2 Ru -","- C74 H74 Cl2 P4 Ru2 -","2","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.0522","0.0359","","","0.0782","0.0851","","","","","","1.023","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079301","26.42","0.005","15.661","0.003","10.368","0.002","90","","90","","90","","4289.9","1.4","173","2","173","2","","","","","","","synthesis as described","7","P n a 21","P 2c -2n","33","compound 7","","","- C50 H56 Cl N O P2 Ru -","- C50 H56 Cl N O P2 Ru -","- C200 H224 Cl4 N4 O4 P8 Ru4 -","4","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.0724","0.0518","","","0.1015","0.1099","","","","","","1.079","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4079302","10.5927","0.0002","17.9038","0.0004","19.2645","0.0004","90","","105.096","0.001","90","","3527.42","0.13","198","2","198","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","Compound 12","","","- C42 H39 Cl O P2 Ru -","- C42 H39 Cl O P2 Ru -","- C168 H156 Cl4 O4 P8 Ru4 -","4","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.0641","0.0394","","","0.0785","0.0879","","","","","","1.075","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079303","14.6304","0.0002","10.2836","0.0002","23.7864","0.0005","90","","102.886","0.001","90","","3488.61","0.11","198","2","198","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","Compound 13","","","- C42 H40 O P2 Ru -","- C42 H40 O P2 Ru -","- C168 H160 O4 P8 Ru4 -","4","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.0729","0.0402","","","0.067","0.0759","","","","","","1.012","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079304","10.8659","0.0001","23.4861","0.0004","15.9331","0.0002","90","","94.569","0.001","90","","4053.17","0.09","198","2","198","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","Compound 14","","","- C47 H46 O1.5 P2 Ru -","- C47 H46 O1.5 P2 Ru -","- C188 H184 O6 P8 Ru4 -","4","1","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.1322","0.0647","","","0.1263","0.1478","","","","","","1.037","","","","has coordinates","268283","2021-08-30","06:31:21",""
"4079305","19.6864","0.0003","20.2907","0.0004","21.8553","0.0005","90","","107.242","0.001","90","","8337.8","0.3","293","2","293","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","Compound 15","","","- C48 H52 O P2 Ru -","- C48 H52 O P2 Ru -","- C384 H416 O8 P16 Ru8 -","8","2","","Reyna-Madrigal, Amira; Moreno-Gurrola, Anabel; Perez-Camacho, Odilia; Navarro-Clemente, M. Elena; Juárez-Saavedra, Patricia; Leyva-Ramirez, Marco A.; Arif, Atta M.; Ernst, Richard D.; Paz-Sandoval, M. Angeles","Half-Sandwich Ruthenium-Phosphine Complexes with Pentadienyl and Oxo- and Azapentadienyl Ligands","Organometallics","2012","31","20","7125","","10.1021/om300657z","","x-ray","0.71073","MoKα","","0.1394","0.0706","","","0.1495","0.1818","","","","","","1.012","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079306","10.822","0.003","15.703","0.005","16.449","0.005","111.656","0.004","91.252","0.002","109.791","0.004","2409.9","1.3","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 Au F3 N O2 -","- C27 H27 Au F3 N O2 -","- C108 H108 Au4 F12 N4 O8 -","4","2","","Smith, Dan A.; Roşca, Dragoş-Adrian; Bochmann, Manfred","Selective Au‒C Cleavage in (C∧N∧C)Au(III) Aryl and Alkyl Pincer Complexes","Organometallics","2012","31","17","5998","","10.1021/om300666j","","","0.71075","MoKα","","0.0246","0.0195","","","0.0383","0.0393","","","","","","0.933","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079307","11.3438","0.0009","11.7899","0.0007","13.5826","0.0007","114.937","0.005","91.198","0.005","112.676","0.007","1482.9","0.2","140","2","140","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H32 Au F4 N O2 -","- C33 H32 Au F4 N O2 -","- C66 H64 Au2 F8 N2 O4 -","2","1","","Smith, Dan A.; Roşca, Dragoş-Adrian; Bochmann, Manfred","Selective Au‒C Cleavage in (C∧N∧C)Au(III) Aryl and Alkyl Pincer Complexes","Organometallics","2012","31","17","5998","","10.1021/om300666j","","","0.71073","MoKα","","0.0591","0.0506","","","0.128","0.1351","","","","","","1.094","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079308","7.1567","0.0014","10.841","0.002","15.938","0.003","79.87","0.03","78.42","0.03","84.22","0.03","1189.8","0.4","140","2","140","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H32 Au N -","- C27 H32 Au N -","- C54 H64 Au2 N2 -","2","1","","Smith, Dan A.; Roşca, Dragoş-Adrian; Bochmann, Manfred","Selective Au‒C Cleavage in (C∧N∧C)Au(III) Aryl and Alkyl Pincer Complexes","Organometallics","2012","31","17","5998","","10.1021/om300666j","","","0.71073","MoKα","","0.0823","0.0588","","","0.1212","0.1301","","","","","","1.057","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079309","22.474","0.0014","11.8708","0.0004","23.1806","0.0008","90","","92.239","0.001","90","","6179.5","0.5","200","2","200","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C68 H74 Li2 O8 P4 -","- C68 H74 Li2 O8 P4 -","- C272 H296 Li8 O32 P16 -","4","0.5","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.0922","0.0545","","","0.1385","0.1618","","","","","","1.012","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079310","10.9642","0.0002","14.2926","0.0003","21.7885","0.0004","100.838","0.001","100.876","0.001","92.492","0.001","3282.22","0.11","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H42 Li N O2 P2 -","- C36 H42 Li N O2 P2 -","- C144 H168 Li4 N4 O8 P8 -","4","2","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1019","0.0629","","","0.1566","0.182","","","","","","1.019","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079311","19.5177","0.0006","10.7808","0.0004","21.5695","0.0008","90","","107.415","0.001","90","","4330.5","0.3","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H58 Li N O3 P2 -","- C46 H58 Li N O3 P2 -","- C184 H232 Li4 N4 O12 P8 -","4","1","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.0747","0.0549","","","0.1537","0.1734","","","","","","1.01","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079312","12.2935","0.0006","12.2935","0.0006","29.6984","0.0017","90","","90","","90","","4488.3","0.4","200","2","200","2","","","","","","","","7","P 43 21 2","P 4nw 2abw","96","","","","- C41 H53 Cl4 Cr Li2 O4 P2 -","- C41 H53 Cl4 Cr Li2 O4 P2 -","- C164 H212 Cl16 Cr4 Li8 O16 P8 -","4","0.5","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.044","0.0392","","","0.095","0.0986","","","","","","1.033","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079313","12.0461","0.0003","16.7975","0.0004","17.8616","0.0004","63.288","0.001","71.886","0.001","75.243","0.001","3040.21","0.13","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C64 H70 Cl2 Cr Li O3.5 P4 -","- C64 H70 Cl2 Cr Li O3.5 P4 -","- C128 H140 Cl4 Cr2 Li2 O7 P8 -","2","1","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1339","0.0657","","","0.1589","0.1913","","","","","","0.995","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079314","13.8435","0.0004","14.4075","0.0005","16.5489","0.0005","86.82","0.002","82.579","0.001","69.689","0.001","3069.32","0.17","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C136 H148 Cr2 O16 P8 -","- C136 H148 Cr2 O16 P8 -","- C136 H148 Cr2 O16 P8 -","1","0.5","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.114","0.0704","","","0.1546","0.173","","","","","","1.026","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079315","19.0788","0.0007","13.3281","0.0006","19.2683","0.0008","90","","111.565","0.002","90","","4556.7","0.3","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43.5 H53 Cl2 Cr N O3.5 P2 -","- C43.5 H53 Cl2 Cr N O3.5 P2 -","- C174 H212 Cl8 Cr4 N4 O14 P8 -","4","1","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1053","0.0598","","","0.151","0.1796","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079316","10.0967","0.0007","17.0346","0.0011","17.5685","0.0012","98.269","0.003","106.698","0.003","96.575","0.003","2825.2","0.3","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H66 Cl2 Cr N O4.5 P2 -","- C52 H66 Cl2 Cr N O4.5 P2 -","- C104 H132 Cl4 Cr2 N2 O9 P4 -","2","1","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1149","0.0774","","","0.2017","0.2416","","","","","","1.03","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079317","12.174","0.003","12.264","0.003","18.999","0.005","101.532","0.004","101.101","0.004","110.256","0.004","2499.5","1.1","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H64 Cl2 Cr N O5 P2 -","- C51 H64 Cl2 Cr N O5 P2 -","- C102 H128 Cl4 Cr2 N2 O10 P4 -","2","1","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1736","0.0796","","","0.1605","0.1944","","","","","","1.027","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079318","36.278","0.007","15.547","0.003","22.263","0.005","90","","119.787","0.002","90","","10898","4","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C88 H108 Al4 Cl8 Cr2 N2 O2 P4 -","- C88 H108 Al4 Cl8 Cr2 N2 O2 P4 -","- C352 H432 Al16 Cl32 Cr8 N8 O8 P16 -","4","0.5","","Kulangara, Shaneesh Vadake; Mason, Chris; Juba, Michael; Yang, Yun; Thapa, Indira; Gambarotta, Sandro; Korobkov, Ilia; Duchateau, Rob","Synthesis and Catalytic Oligomerization Activity of Chromium Catalysts of Ligand Systems with Switchable Connectivity","Organometallics","2012","31","17","6438","","10.1021/om300673u","","","0.71073","MoKα","","0.1214","0.0654","","","0.1578","0.1893","","","","","","1.04","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079319","8.7587","0.001","20.7199","0.0019","11.3341","0.0015","90","","106.939","0.013","90","","1967.7","0.4","150.05","0.1","150.05","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 B Cl2 F4 N3 Ru -","- C15 H24 B Cl2 F4 N3 Ru -","- C60 H96 B4 Cl8 F16 N12 Ru4 -","4","1","","Sabater, Sara; Mata, Jose A.; Peris, Eduardo","Heterobimetallic Iridium‒Ruthenium Assemblies through an Ambidentate Triazole-Diylidene Ligand: Electrochemical Properties and Catalytic Behavior in a Cascade Reaction","Organometallics","2012","31","17","6450","","10.1021/om300675p","","","0.7107","MoKα","","0.0616","0.0412","","","0.0873","0.0986","","","","","","1.064","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079320","7.8849","0.0002","12.4914","0.0003","14.3261","0.0003","81.278","0.001","88.846","0.001","75.726","0.001","1351.43","0.06","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C22 H27 B Cl2 N7 O3 P Ru -","- C22 H27 B Cl2 N7 O3 P Ru -","- C44 H54 B2 Cl4 N14 O6 P2 Ru2 -","2","1","","Joslin, Evan E.; McMullin, Claire L.; Gunnoe, T. Brent; Cundari, Thomas R.; Sabat, Michal; Myers, William H.","Catalytic Hydroarylation of Ethylene Using TpRu(L)(NCMe)Ph (L = 2,6,7-Trioxa-1-phosphabicyclo[2,2,1]heptane): Comparison to TpRu(L′)(NCMe)Ph Systems (L′ = CO, PMe3, P(pyr)3, or P(OCH2)3CEt)","Organometallics","2012","31","19","6851","","10.1021/om300676e","","","0.71073","MoKα","","0.0495","0.0386","","","0.111","0.1224","","","","","","0.898","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079321","16.853","0.0005","9.485","0.0003","22.4374","0.0006","90","","97.109","0.001","90","","3559.06","0.18","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H18 Au Ir4 O11 P -","- C30 H18 Au Ir4 O11 P -","- C120 H72 Au4 Ir16 O44 P4 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.0369","0.0306","","","0.0738","0.0776","","","","","","1.046","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079322","36.675","0.015","15.048","0.006","17.918","0.007","90","","99.71","0.009","90","","9747","7","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H24 Au Ir4 O11 P -","- C51 H24 Au Ir4 O11 P -","- C408 H192 Au8 Ir32 O88 P8 -","8","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.0924","0.0581","","","0.1043","0.1162","","","","","","1.08","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079323","23.4673","0.0012","15.1658","0.0008","26.0618","0.0013","90","","112.857","0.001","90","","8547.1","0.8","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C89 H72 Au4 Ir4 O9 P4 -","- C89 H72 Au4 Ir4 O9 P4 -","- C356 H288 Au16 Ir16 O36 P16 -","4","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.056","0.0347","","","0.0767","0.0852","","","","","","1.012","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079324","13.1907","0.0008","14.109","0.0008","25.7346","0.0015","87.811","0.001","79.125","0.001","79.825","0.001","4629.4","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C99 H77 Au3 Ir4 O9 P4 -","- C99 H77 Au3 Ir4 O9 P4 -","- C198 H154 Au6 Ir8 O18 P8 -","2","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.1111","0.0689","","","0.1304","0.1443","","","","","","1.095","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079325","13.8353","0.0015","19.656","0.002","19.87","0.002","75.375","0.002","74.007","0.002","75.261","0.002","4925.9","0.9","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C111 H88 Au4 Ir4 O9 P4 -","- C111 H88 Au4 Ir4 O9 P4 -","- C222 H176 Au8 Ir8 O18 P8 -","2","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.0563","0.0363","","","0.0791","0.0938","","","","","","1.025","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079326","13.7892","0.0014","13.9054","0.0014","17.8443","0.0018","85.321","0.002","75.087","0.002","65.024","0.002","2995.7","0.5","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H42 Au2 Ir4 O9 P3 -","- C60 H42 Au2 Ir4 O9 P3 -","- C120 H84 Au4 Ir8 O18 P6 -","2","1","","Adams, Richard D.; Chen, Mingwei","Synthesis and Structures of Iridium‒Gold Carbonyl Cluster Compounds Containing Methyl and σ-Aryl Ligands","Organometallics","2012","31","17","6457","","10.1021/om300678c","","","0.71073","MoKα","","0.0831","0.058","","","0.128","0.1398","","","","","","1.087","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079327","12.016","0.0007","26.7052","0.0016","13.3195","0.0008","90","","93.049","0.001","90","","4268","0.4","110","2","110","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H56 F3 N3 O4 Os S -","- C45 H56 F3 N3 O4 Os S -","- C180 H224 F12 N12 O16 Os4 S4 -","4","1","","Buil, María L.; Cadierno, Victorio; Esteruelas, Miguel A.; Gimeno, José; Herrero, Juana; Izquierdo, Susana; Oñate, Enrique","Selective Hydration of Nitriles to Amides Promoted by an Os‒NHC Catalyst: Formation and X-ray Characterization of κ2-Amidate Intermediates","Organometallics","2012","31","19","6861","","10.1021/om3006799","","","0.71073","MoKα","","0.0417","0.0272","","","0.0596","0.0652","","","","","","0.974","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079328","20.631","0.003","21.915","0.003","18.194","0.003","91.0422","0.0017","89.924","0.003","94.596","0.003","8198","2","153","2","153","2","","","","","","","","8","P -1","-P 1","2","","","","- C153.5 H152 Cl7 F18 N2 O P15 Pt6 -","- C153.5 H152 Cl7 F18 N2 O P15 Pt6 -","- C307 H304 Cl14 F36 N4 O2 P30 Pt12 -","2","1","","Goto, Eri; Begum, Rowshan Ara; Hosokawa, Aya; Yamamoto, Chie; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged Pt2M2Pt2Hexanuclear Metal Strings (M = Pt, Pd) Derived from Reductive Coupling of Pt2M Building Blocks Supported by Triphosphine Ligands","Organometallics","2012","31","24","8482","","10.1021/om300680p","","","0.71075","MoKα","","","0.0749","","","","0.223","","","","","","0.998","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079329","20.405","0.004","21.847","0.004","18.268","0.003","91.459","0.003","89.822","0.002","94.575","0.003","8115","3","153","2","153","2","","","","","","","","9","P -1","-P 1","2","","","","- C153.5 H152 Cl7 F18 N2 O P15 Pd2 Pt4 -","- C153.5 H152 Cl7 F18 N2 O P15 Pd2 Pt4 -","- C307 H304 Cl14 F36 N4 O2 P30 Pd4 Pt8 -","2","1","","Goto, Eri; Begum, Rowshan Ara; Hosokawa, Aya; Yamamoto, Chie; Kure, Bunsho; Nakajima, Takayuki; Tanase, Tomoaki","Hydride-Bridged Pt2M2Pt2Hexanuclear Metal Strings (M = Pt, Pd) Derived from Reductive Coupling of Pt2M Building Blocks Supported by Triphosphine Ligands","Organometallics","2012","31","24","8482","","10.1021/om300680p","","","0.71075","MoKα","","","0.0629","","","","0.193","","","","","","1.014","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079330","9.8633","0.0002","19.018","0.0003","22.4013","0.0005","90","","90","","90","","4202.04","0.14","200","2","200","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C34 H36 B Cl7 N7 P Ru -","- C34 H36 B Cl7 N7 P Ru -","- C136 H144 B4 Cl28 N28 P4 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0778","0.0536","","","0.1325","0.172","","","","","","1.116","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079331","8.1942","0.0002","19.313","0.0003","19.9311","0.0004","90","","90","","90","","3154.19","0.11","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H34 B N10 P Ru -","- C32 H34 B N10 P Ru -","- C128 H136 B4 N40 P4 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0483","0.0344","","","0.0884","0.1147","","","","","","1.226","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079332","13.3822","0.0011","15.9553","0.0011","18.7217","0.0011","90","","104.678","0.003","90","","3866.9","0.5","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 B N10 O4 P Ru -","- C38 H40 B N10 O4 P Ru -","- C152 H160 B4 N40 O16 P4 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0927","0.0473","","","0.0847","0.0979","","","","","","1.06","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079333","11.0468","0.0001","14.3383","0.0002","16.6963","0.0003","90","","105.738","0.001","90","","2545.43","0.06","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 B N9 Ru S -","- C20 H28 B N9 Ru S -","- C80 H112 B4 N36 Ru4 S4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0365","0.031","","","0.0761","0.0811","","","","","","1.092","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079334","9.027","0.0002","16.176","0.0004","16.069","0.0004","90","","90","","90","","2346.41","0.1","200","2","200","2","","","","","","","","6","P b n 21","P 2c -2ab","33","","","","- C22 H26 B N7 O Ru -","- C22 H26 B N7 O Ru -","- C88 H104 B4 N28 O4 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0583","0.0409","","","0.1026","0.1326","","","","","","1.204","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079335","10.9704","0.0006","19.2553","0.001","19.7665","0.001","90","","94.333","0.003","90","","4163.5","0.4","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C38 H44 B F6 N7 O P2 Ru -","- C38 H44 B F6 N7 O P2 Ru -","- C152 H176 B4 F24 N28 O4 P8 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0952","0.0576","","","0.1448","0.1705","","","","","","1.085","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079336","10.6308","0.0001","21.975","0.0003","18.3342","0.0002","90","","91.856","0.001","90","","4280.84","0.08","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 B F6 N7 O P2 Ru -","- C36 H40 B F6 N7 O P2 Ru -","- C144 H160 B4 F24 N28 O4 P8 Ru4 -","4","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.066","0.0546","","","0.1604","0.17","","","","","","1.071","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079337","15.21","0.0002","18.029","0.0003","23.847","0.0005","90","","90","","90","","6539.4","0.2","200","2","200","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H33 B I N9 Ru -","- C21 H33 B I N9 Ru -","- C168 H264 B8 I8 N72 Ru8 -","8","1","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.0982","0.059","","","0.1543","0.1747","","","","","","1.04","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079338","11.9095","0.0003","14.7757","0.0003","18.7027","0.0005","90","","98.505","0.001","90","","3254.94","0.14","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H76 B2 Br2 N18 O3 Ru2 -","- C52 H76 B2 Br2 N18 O3 Ru2 -","- C104 H152 B4 Br4 N36 O6 Ru4 -","2","0.5","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.1162","0.0663","","","0.1736","0.2028","","","","","","1.032","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079339","9.7743","0.0013","13.5331","0.0019","19.326","0.003","87.652","0.003","87.166","0.003","85.888","0.003","2544.9","0.6","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H28 B I N8 Ru -","- C19 H28 B I N8 Ru -","- C76 H112 B4 I4 N32 Ru4 -","4","2","","Lo, Yih-Hsing; Wang, Tsang-Hsiu; Lee, Chia-Yi; Feng, Ying-Hsuan","Preparation, Characterization, and Reactivity of Azido Complex Containing a Tp(tBuNC)(PPh3)Ru Fragment and Ruthenium-Catalyzed Cycloaddition of Organic Azides with Alkynes in Organic and Aqueous Media","Organometallics","2012","31","19","6887","","10.1021/om300687a","","","0.71073","MoKα","","0.1027","0.0814","","","0.194","0.203","","","","","","1.116","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079340","11.2129","0.0002","17.4577","0.0003","19.2564","0.0003","90","","103.973","0.001","90","","3657.93","0.11","193","2","193","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C29 H50 Au Cl3 O P2 Si2 -","- C29 H50 Au Cl3 O P2 Si2 -","- C116 H200 Au4 Cl12 O4 P8 Si8 -","4","1","","Gualco, Pauline; Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier","Gold-Mediated Insertion of Oxygen into Silicon–Silicon Bond: An Original Au(I)/Au(III) Redox Sequence","Organometallics","2012","31","17","6001","","10.1021/om3006905","","","0.71073","MoKα","","0.0365","0.0242","","","0.054","0.0586","","","","","","1.014","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079341","10.5602","0.0002","16.2529","0.0003","36.3419","0.0007","90","","90","","90","","6237.5","0.2","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H36 Au Cl P2 Si2 -","- C30 H36 Au Cl P2 Si2 -","- C240 H288 Au8 Cl8 P16 Si16 -","8","2","","Gualco, Pauline; Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier","Gold-Mediated Insertion of Oxygen into Silicon‒Silicon Bond: An Original Au(I)/Au(III) Redox Sequence","Organometallics","2012","31","17","6001","","10.1021/om3006905","","","0.71073","MoKα","","0.0618","0.0408","","","0.0676","0.0734","","","","","","1.025","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079342","12.321","0.003","10.964","0.002","17.109","0.003","90","","96.98","0.03","90","","2294.1","0.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Chlorido-(η^6^-p-cymene)-{κ^2^ <i>C</i>,<i>N</i>-3-methyl-1- (pyrid-2-ylmethyl)-2,3-dihydro-imidazole-2-ylidene}-ruthenium(II) hexafluorophosphate","","- C20 H25 Cl F6 N3 P Ru -","- C20 H25 Cl F6 N3 P Ru -","- C80 H100 Cl4 F24 N12 P4 Ru4 -","4","1","","Fernández, Francys E.; Puerta, M. Carmen; Valerga, Pedro","Ruthenium(II) Picolyl-NHC Complexes: Synthesis, Characterization, and Catalytic Activity in Amine N-alkylation and Transfer Hydrogenation Reactions","Organometallics","2012","31","19","6868","","10.1021/om300692a","","x-ray","0.71073","MoKα","","0.0793","0.0638","","","0.185","0.1961","","","","","","1.068","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079343","8.399","0.0017","10.152","0.002","14.854","0.003","91.81","0.03","103.06","0.03","106.17","0.03","1178.9","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Chlorido-(η^6^-p-cymene)-{κ^2^ <i>C</i>,<i>N</i>-4,5-dichloro-3-methyl-1- (pyrid-2-ylmethyl)-2,3-dihydro-imidazole-2-ylidene}-ruthenium(II) hexafluorophosphate","","- C20 H23 Cl3 F6 N3 P Ru -","- C20 H23 Cl3 F6 N3 P Ru -","- C40 H46 Cl6 F12 N6 P2 Ru2 -","2","1","","Fernández, Francys E.; Puerta, M. Carmen; Valerga, Pedro","Ruthenium(II) Picolyl-NHC Complexes: Synthesis, Characterization, and Catalytic Activity in Amine N-alkylation and Transfer Hydrogenation Reactions","Organometallics","2012","31","19","6868","","10.1021/om300692a","","x-ray","0.71073","MoKα","","0.0414","0.0372","","","0.1073","0.1272","","","","","","1.059","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079344","13.1225","0.0006","16.4596","0.0008","17.07","0.0008","115.228","0.003","96.147","0.003","98.341","0.003","3240.7","0.3","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C110 H36 O S2 W -","- C110 H36 O S2 W -","- C220 H72 O2 S4 W2 -","2","1","","Wang, Shu-Jou; Yeh, Wen-Yann","C60-Induced Alkyne Cycloaddition with W(CO)(PhC≡CPh)3","Organometallics","2012","31","17","6491","","10.1021/om3006933","","","0.71073","MoKα","","0.1518","0.0696","","","0.1151","0.1404","","","","","","0.974","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079345","12.575","0.003","15.011","0.004","18.114","0.004","101.157","0.004","90.189","0.004","103.451","0.003","3258.4","1.4","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H30 O2 W -","- C44 H30 O2 W -","- C176 H120 O8 W4 -","4","2","","Wang, Shu-Jou; Yeh, Wen-Yann","C60-Induced Alkyne Cycloaddition with W(CO)(PhC≡CPh)3","Organometallics","2012","31","17","6491","","10.1021/om3006933","","","0.71073","MoKα","","0.1186","0.0676","","","0.1406","0.1637","","","","","","1.118","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079346","16.3857","0.0006","6.8796","0.0003","12.1386","0.0005","90","","109.105","0.004","90","","1292.98","0.1","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 Cl Mn N O6 -","- C10 H9 Cl Mn N O6 -","- C40 H36 Cl4 Mn4 N4 O24 -","4","1","","Sulieman, Samer; Can, Daniel; Mertens, John; N’Dongo, Harmel W. Peindy; Liu, Yu; Schmutz, Paul; Bauwens, Matthias; Spingler, Bernhard; Alberto, Roger","Cyclopentadienyl-Based Amino Acids (Cp-aa) As Phenylalanine Analogues for Tumor Targeting: Syntheses and Biological Properties of [(Cp-aa)M(CO)3](M = Mn, Re,99mTc)","Organometallics","2012","31","19","6880","","10.1021/om300695k","","","0.7107","MoKα","","0.0898","0.075","","","0.2105","0.2157","","","","","","1.162","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079347","16.2347","0.001","7.0811","0.0003","12.2183","0.0005","90","","107.898","0.006","90","","1336.63","0.12","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 Cl N O6 Re -","- C10 H9 Cl N O6 Re -","- C40 H36 Cl4 N4 O24 Re4 -","4","1","","Sulieman, Samer; Can, Daniel; Mertens, John; N’Dongo, Harmel W. Peindy; Liu, Yu; Schmutz, Paul; Bauwens, Matthias; Spingler, Bernhard; Alberto, Roger","Cyclopentadienyl-Based Amino Acids (Cp-aa) As Phenylalanine Analogues for Tumor Targeting: Syntheses and Biological Properties of [(Cp-aa)M(CO)3](M = Mn, Re,99mTc)","Organometallics","2012","31","19","6880","","10.1021/om300695k","","","0.7107","MoKα","","0.0756","0.0606","","","0.1594","0.1681","","","","","","1.049","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079348","12.9331","0.0003","6.3626","0.0001","12.5315","0.0002","90","","93.4788","0.0019","90","","1029.29","0.03","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H7 Mn N2 O3 -","- C10 H7 Mn N2 O3 -","- C40 H28 Mn4 N8 O12 -","4","1","","Sulieman, Samer; Can, Daniel; Mertens, John; N’Dongo, Harmel W. Peindy; Liu, Yu; Schmutz, Paul; Bauwens, Matthias; Spingler, Bernhard; Alberto, Roger","Cyclopentadienyl-Based Amino Acids (Cp-aa) As Phenylalanine Analogues for Tumor Targeting: Syntheses and Biological Properties of [(Cp-aa)M(CO)3](M = Mn, Re,99mTc)","Organometallics","2012","31","19","6880","","10.1021/om300695k","","","0.7107","MoKα","","0.0413","0.0291","","","0.068","0.0705","","","","","","1.008","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079349","7.1795","0.0009","11.8709","0.0015","22.508","0.003","90","","90","","90","","1918.3","0.4","223","","223","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H25 Ir -","- C25 H25 Ir -","- C100 H100 Ir4 -","4","1","","Graeupner, Jonathan; Brewster, Timothy P.; Blakemore, James D.; Schley, Nathan D.; Thomsen, Julianne M.; Brudvig, Gary W.; Hazari, Nilay; Crabtree, Robert H.","Electron-Rich CpIr(biphenyl-2,2'-diyl) Complexes with π-Accepting Carbon Donor Ligands.","Organometallics","2012","31","20","7158","7164","10.1021/om300696t","","","0.71075","MoKα","","","0.043","","","","0.067","","","","","","1.122","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079350","25.3156","0.0015","25.3156","0.0015","10.7989","0.0007","90","","90","","90","","6920.8","0.7","223","","223","","","","","","","","","4","P 42 b c","P 4c -2ab","106","","","","- C43 H40 Cl2 Ir2 -","- C43 H40 Cl2 Ir2 -","- C344 H320 Cl16 Ir16 -","8","1","","Graeupner, Jonathan; Brewster, Timothy P.; Blakemore, James D.; Schley, Nathan D.; Thomsen, Julianne M.; Brudvig, Gary W.; Hazari, Nilay; Crabtree, Robert H.","Electron-Rich CpIr(biphenyl-2,2'-diyl) Complexes with π-Accepting Carbon Donor Ligands.","Organometallics","2012","31","20","7158","7164","10.1021/om300696t","","","0.71075","MoKα","","","0.0641","","","","0.091","","","","","","1.153","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079351","12.614","0.0003","12.6942","0.0003","17.5738","0.0004","90","","90","","90","","2814","0.11","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H41 N3 O Si2 Zn -","- C26 H41 N3 O Si2 Zn -","- C104 H164 N12 O4 Si8 Zn4 -","4","1","","Abbina, Srinivas; Du, Guodong","Chiral Amido-Oxazolinate Zinc Complexes for Asymmetric Alternating Copolymerization of CO2and Cyclohexene Oxide","Organometallics","2012","31","21","7394","","10.1021/om3006992","","","0.71073","MoKα","","0.0219","0.02","","","0.0507","0.0515","","","","","","1.036","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079352","8.2758","0.0004","11.7384","0.0006","30.5893","0.0016","90","","90","","90","","2971.6","0.3","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","11070a","","","- C27 H43 N3 O Si2 Zn -","- C27 H43 N3 O Si2 Zn -","- C108 H172 N12 O4 Si8 Zn4 -","4","1","","Abbina, Srinivas; Du, Guodong","Chiral Amido-Oxazolinate Zinc Complexes for Asymmetric Alternating Copolymerization of CO2and Cyclohexene Oxide","Organometallics","2012","31","21","7394","","10.1021/om3006992","","","0.71073","MoKα","","0.0298","0.0278","","","0.0765","0.0779","","","","","","1.049","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079353","21.6521","0.0009","12.6935","0.0006","23.1553","0.0013","90","","110.138","0.002","90","","5975","0.5","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C50 H74 N6 O4 Si4 Zn2 -","- C50 H74 N6 O4 Si4 Zn2 -","- C200 H296 N24 O16 Si16 Zn8 -","4","1","","Abbina, Srinivas; Du, Guodong","Chiral Amido-Oxazolinate Zinc Complexes for Asymmetric Alternating Copolymerization of CO2and Cyclohexene Oxide","Organometallics","2012","31","21","7394","","10.1021/om3006992","","","1.54178","CuKα","","0.0259","0.0245","","","0.0616","0.0623","","","","","","1.043","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079354","17.874","0.005","9.872","0.003","20.461","0.006","90","","108.991","0.005","90","","3413.9","1.7","89","2","89","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","C72 H96 O2 P2 Pt, 0.2(CH2Cl2)","","","- C72.2 H96.4 Cl0.4 O2 P2 Pt -","- C72.2 H96.4 Cl0.4 O2 P2 Pt -","- C144.4 H192.8 Cl0.8 O4 P4 Pt2 -","2","0.5","","Zhang, Pengrong; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen; Patrick, Brian","Platinum Complexes of Alkynyl-Substituted Dimethyldihydropyrenes","Organometallics","2012","31","23","8121","","10.1021/om3007008","","","0.71073","MoKα","","0.0695","0.0495","","","0.1089","0.1176","","","","","","1.059","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079355","9.8761","0.0003","22.2557","0.0007","18.5865","0.0005","90","","106.536","0.002","90","","3916.3","0.2","90","2","90","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[(PhC(O)tBuDHP-CC)2-Pt(PEt2)2] + 0.5 hexane","","","- C85 H107 O2 P2 Pt -","- C85 H107 O2 P2 Pt -","- C170 H214 O4 P4 Pt2 -","2","0.5","","Zhang, Pengrong; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen; Patrick, Brian","Platinum Complexes of Alkynyl-Substituted Dimethyldihydropyrenes","Organometallics","2012","31","23","8121","","10.1021/om3007008","","","0.71073","MoKα","","0.1045","0.0681","","","0.1725","0.1962","","","","","","1.071","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079356","9.5461","0.0003","12.4694","0.0005","21.4334","0.0008","76.936","0.001","77.888","0.002","68.018","0.001","2282.35","0.15","90","2","90","2","","","","","","","","6","P -1","-P 1","2","C106 H100 O2 P2 Pt, 2(C H2 Cl2)","","","- C108 H104 Cl4 O2 P2 Pt -","- C108 H104 Cl4 O2 P2 Pt -","- C108 H104 Cl4 O2 P2 Pt -","1","0.5","","Zhang, Pengrong; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen; Patrick, Brian","Platinum Complexes of Alkynyl-Substituted Dimethyldihydropyrenes","Organometallics","2012","31","23","8121","","10.1021/om3007008","","","0.71073","MoKα","","0.0412","0.0406","","","0.1083","0.1088","","","","","","1.053","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079357","12.5087","0.0005","13.9309","0.0006","14.9918","0.0006","74.057","0.001","83.274","0.001","65.509","0.001","2285.92","0.16","90","2","90","2","","","","","","","","4","P -1","-P 1","2","[(DHP-CC-)2Pt(PPh3)2] + C6H14","","","- C106 H110 P2 Pt -","- C106 H110 P2 Pt -","- C106 H110 P2 Pt -","1","0.5","","Zhang, Pengrong; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen; Patrick, Brian","Platinum Complexes of Alkynyl-Substituted Dimethyldihydropyrenes","Organometallics","2012","31","23","8121","","10.1021/om3007008","","","0.71073","MoKα","","0.0308","0.0304","","","0.0927","0.093","","","","","","1.086","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079358","15.6482","0.0007","23.2366","0.001","24.2319","0.0011","90","","93.428","0.002","90","","8795.2","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C104 H104 P2 Pt -","- C90 H88 P2 Pt -","- C360 H352 P8 Pt4 -","4","0.5","","Zhang, Pengrong; Berg, David J.; Mitchell, Reginald H.; Oliver, Allen; Patrick, Brian","Platinum Complexes of Alkynyl-Substituted Dimethyldihydropyrenes","Organometallics","2012","31","23","8121","","10.1021/om3007008","","","0.71073","MoKα","","0.0712","0.0593","","","0.1208","0.1237","","","","","","1.194","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079359","7.8986","0.0001","11.002","0.0002","20.4886","0.0001","90","","97.825","0.001","90","","1763.89","0.04","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","in manuscript 2a","","","- C24 H46 Cu2 F12 N4 P4 -","- C24 H46 Cu2 F12 N4 P4 -","- C48 H92 Cu4 F24 N8 P8 -","2","0.5","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0386","0.0342","","","0.0893","0.0928","","","","","","1.066","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079360","10.535","0.0004","14.1754","0.0005","18.8638","0.0007","82.406","0.001","81.66","0.001","72.915","0.001","2652.32","0.17","200","2","200","2","","","","","","","","7","P -1","-P 1","2","in manuscript 2b","","","- C41 H64 Cl2 Cu2 F12 N4 P4 -","- C41.001 H64.002 Cl2.002 Cu2 F12 N4 P4 -","- C82.002 H128.004 Cl4.004 Cu4 F24 N8 P8 -","2","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0735","0.0503","","","0.1171","0.1294","","","","","","1.019","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079361","10.3816","0.0007","15.9198","0.0011","23.8645","0.0017","90","","91.222","0.002","90","","3943.3","0.5","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","in manuscript 3","","","- C30 H58 Cu F6 N4 P3 -","- C30 H58 Cu F6 N4 P3 -","- C120 H232 Cu4 F24 N16 P12 -","4","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.1005","0.0739","","","0.1748","0.1892","","","","","","1.101","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079362","11.7472","0.0007","19.789","0.0011","14.3583","0.0008","90","","109.438","0.001","90","","3147.6","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","in manuscript 4a","","","- C24 H46 Br2 Cu2 N4 P2 -","- C24 H46 Br2 Cu2 N4 P2 -","- C96 H184 Br8 Cu8 N16 P8 -","4","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0474","0.03","","","0.0649","0.0702","","","","","","1.016","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079363","12.1724","0.0011","15.224","0.0014","14.9025","0.0014","90","","94.477","0.002","90","","2753.2","0.4","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","in manuscript 4b","","","- C44.45 H72.05 Br4 Cl1.55 Cu4 N4 P2 -","- C44.4332 H72.0828 Br4 Cl1.568 Cu4 N4 P2 -","- C88.8664 H144.166 Br8 Cl3.136 Cu8 N8 P4 -","2","0.5","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0454","0.0325","","","0.0832","0.0879","","","","","","1.039","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079364","24.7326","0.0001","11.3777","0.0002","20.7465","0.0004","90","","112.914","0.001","90","","5377.39","0.15","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","in manuscript 6a","","","- C17 H33 Cl2 Cu F6 N2 P2 -","- C17 H33 Cl2 Cu F6 N2 P2 -","- C136 H264 Cl16 Cu8 F48 N16 P16 -","8","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.1274","0.1002","","","0.2733","0.2936","","","","","","1.098","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079365","24.8999","0.0007","25.0763","0.0007","21.3452","0.0006","90","","122.457","0.001","90","","11246","0.6","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","in manuscript 6b","","","- C43.5 H69 Cl3 Cu2 F12 N4 P4 -","- C43.5 H69 Cl3 Cu2 F12 N4 P4 -","- C348 H552 Cl24 Cu16 F96 N32 P32 -","8","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0829","0.0511","","","0.1209","0.1374","","","","","","1.037","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079366","11.6179","0.0007","12.9619","0.0008","16.0697","0.001","80.063","0.001","84.338","0.001","73.271","0.001","2279.7","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","in manuscript 10a","","","- C32 H52 Cl4 Cu2 F12 N8 P2 -","- C32 H52 Cl4 Cu2 F12 N8 P2 -","- C64 H104 Cl8 Cu4 F24 N16 P4 -","2","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0533","0.0357","","","0.0782","0.0848","","","","","","1.013","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079367","9.7721","0.001","11.8877","0.0012","16.7399","0.0017","85.132","0.002","88.307","0.002","66.628","0.002","1778.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","in manuscript 10b","","","- C32 H56 B2 Cu2 N8 -","- C32 H56 B2 Cu2 N8 -","- C64 H112 B4 Cu4 N16 -","2","1","","Kühnel, Erik; Shishkov, Igor V.; Rominger, Frank; Oeser, Thomas; Hofmann, Peter","Synthesis and Structures of Copper(I) Complexes with Phosphino-Functionalized N-Heterocyclic Carbenes (NHCP) and Bis-N-Heterocyclic Carbenes (Bis-NHC)","Organometallics","2012","31","22","8000","","10.1021/om300701u","","","0.71073","MoKα","","0.0695","0.0405","","","0.0883","0.0982","","","","","","0.994","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079368","8.579","0.002","11.799","0.002","14.702","0.003","101.2","0.03","90.71","0.03","91.07","0.03","1459.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Moris-253 (Tatyana)","","","- C16 H16 F2 N2 -","- C16 H16 F2 N2 -","- C64 H64 F8 N8 -","4","2","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.0831","0.0536","","","0.135","0.1482","","","","","","1.052","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079369","11.659","0.002","12.707","0.003","15.017","0.003","93.24","0.02","112.97","0.03","100.56","0.03","1993.4","0.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Moris-250 (Tatiana)","","","- C24 H20 F2 N2 -","- C24 H20 F2 N2 -","- C96 H80 F8 N8 -","4","2","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.1616","0.075","","","0.1898","0.2191","","","","","","1.051","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079370","8.029","0.002","12.698","0.002","16.824","0.003","90","","97.21","0.03","90","","1701.7","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Moris-199 (Tatiana)","","","- C16 H8 F10 N2 -","- C16 H8 F10 N2 -","- C64 H32 F40 N8 -","4","1","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.1113","0.0489","","","0.1258","0.1494","","","","","","0.915","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079371","16.809","0.003","16.277","0.003","11.616","0.002","90","","99.09","0.03","90","","3138.2","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Moris-195 (Tatiana)","","","- C16 H7 F9 N2 -","- C16 H7 F9 N2 -","- C128 H56 F72 N16 -","8","1","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.0936","0.0457","","","0.1155","0.1322","","","","","","0.94","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079372","16.37","0.003","10.527","0.002","20.018","0.004","90","","98.81","0.03","90","","3408.9","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Moris-247 (Tatiana)","","","- C36 H46 N6 Ti -","- C36 H46 N6 Ti -","- C144 H184 N24 Ti4 -","4","1","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.0736","0.0509","","","0.131","0.1398","","","","","","1.056","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079373","11.411","0.002","19.071","0.004","26.934","0.005","101.71","0.03","97.29","0.03","100.2","0.03","5567","2","240","2","240","2","","","","","","","","5","P -1","-P 1","2","Moris-254(Tatyana)","","","- C54 H63 F6 N9 Ti1.5 -","- C54 H63 F6 N9 Ti1.5 -","- C216 H252 F24 N36 Ti6 -","4","2","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.1403","0.0866","","","0.2483","0.2695","","","","","","0.949","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079374","11.929","0.002","17.908","0.003","18.271","0.004","90","","98.15","0.03","90","","3863.7","1.3","240","2","240","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Moris-224 (Tatiana)","","","- C36 H26 F20 N6 Ti -","- C36 H26 F20 N6 Ti -","- C144 H104 F80 N24 Ti4 -","4","0.5","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.2288","0.0754","","","0.1504","0.1926","","","","","","0.846","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079375","12.079","0.002","17.913","0.004","18.634","0.004","90","","98.97","0.03","90","","3982.6","1.4","240","2","240","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Moris-222 (Tatiana)","","","- C18 H13 F10 N3 Zr0.5 -","- C18 H13 F10 N3 Zr0.5 -","- C144 H104 F80 N24 Zr4 -","8","1","","Elkin, Tatyana; Aharonovich, Sinai; Botoshansky, Mark; Eisen, Moris S.","Synthesis and Characterization of Group 4 Fluorinated Bis(amidinates) and Their Reactivity in the Formation of Elastomeric Polypropylene","Organometallics","2012","31","21","7404","","10.1021/om300702s","","","0.71073","MoKα","","0.0727","0.0428","","","0.092","0.1011","","","","","","0.928","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079376","9.318","0.002","18.306","0.003","24.3","0.004","75.109","0.011","89.514","0.016","84.951","0.013","3989.8","1.3","93","2","93","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H51 Cl2 N2 O3 P Ru -","- C42 H51 Cl2 N2 O3 P Ru -","- C168 H204 Cl8 N8 O12 P4 Ru4 -","4","2","","Bantreil, Xavier; Poater, Albert; Urbina-Blanco, César A.; Bidal, Yannick D.; Falivene, Laura; Randall, Rebecca A. M.; Cavallo, Luigi; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Synthesis and Reactivity of Ruthenium Phosphite Indenylidene Complexes","Organometallics","2012","31","21","7415","","10.1021/om300703p","","","0.71073","MoKα","","0.1","0.0778","","","0.1971","0.213","","","","","","1.073","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079377","9.127","0.002","11.772","0.003","21.891","0.006","81.229","0.008","86.571","0.009","76.206","0.008","2256.8","1","93","2","93","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H51 Cl2 N2 O3 P Ru -","- C54 H51 Cl2 N2 O3 P Ru -","- C108 H102 Cl4 N4 O6 P2 Ru2 -","2","1","","Bantreil, Xavier; Poater, Albert; Urbina-Blanco, César A.; Bidal, Yannick D.; Falivene, Laura; Randall, Rebecca A. M.; Cavallo, Luigi; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Synthesis and Reactivity of Ruthenium Phosphite Indenylidene Complexes","Organometallics","2012","31","21","7415","","10.1021/om300703p","","","0.71073","MoKα","","0.0722","0.0638","","","0.1718","0.1849","","","","","","1.08","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079378","9.7848","0.001","13.5336","0.0013","18.4873","0.0018","90","","90","","90","","2448.2","0.4","208","2","208","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C19 H30 Br2 Cl2 P2 Pt -","- C19 H30 Br2 Cl2 P2 Pt -","- C76 H120 Br8 Cl8 P8 Pt4 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0261","0.0243","","","0.053","0.0535","","","","","","0.975","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079379","7.3636","0.0012","12.677","0.002","10.2645","0.0017","90","","96.802","0.002","90","","951.4","0.3","208","2","208","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H31 Cl P2 Pt -","- C15 H31 Cl P2 Pt -","- C30 H62 Cl2 P4 Pt2 -","2","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0219","0.0214","","","0.05","0.0503","","","","","","0.963","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079380","15.3682","0.0015","24.952","0.002","26.136","0.003","90","","90","","90","","10022.3","1.7","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H53 Cl7 P2 Pt -","- C27 H47 Cl P2 Pt -","- C324 H564 Cl12 P24 Pt12 -","12","3","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0541","0.0464","","","0.1189","0.1234","","","","","","1.108","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079381","10.7821","0.0015","21.19","0.003","29.56","0.004","90","","90","","90","","6753.7","1.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C57 H100 Cl8 P6 Pt2 -","- C54 H94 P6 Pt2 -","- C216 H376 P24 Pt8 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0346","0.0313","","","0.0699","0.071","","","","","","1.048","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079382","8.768","0.006","20.341","0.013","21.435","0.014","90","","90","","90","","3823","4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C41 H42 Cl4 P2 Pt -","- C41 H42 Cl4 P2 Pt -","- C164 H168 Cl16 P8 Pt4 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0306","0.027","","","0.0629","0.0651","","","","","","1.033","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079383","19.7843","0.001","19.7843","0.001","10.6175","0.001","90","","90","","90","","4155.9","0.5","100","2","100","2","","","","","","","","5","I 41","I 4bw","80","","","","- C14 H28 I2 P2 Pt -","- C14 H28 I2 P2 Pt -","- C112 H224 I16 P16 Pt8 -","8","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0287","0.0269","","","0.0586","0.0597","","","","","","0.983","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079384","7.2371","0.0012","12.4943","0.0019","10.087","0.0015","90","","97.173","0.009","90","","905","0.2","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H28 Cl2 O0 P2 Pt -","- C14 H28 Cl2 P2 Pt -","- C28 H56 Cl4 P4 Pt2 -","2","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","1.54178","CuKα","","0.0695","0.0644","","","0.1646","0.1693","","","","","","1.001","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079385","10.5443","0.0003","13.0578","0.0005","17.5526","0.0006","90","","90","","90","","2416.74","0.14","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H35 Cl Fe P2 Pt -","- C23 H35 Cl Fe P2 Pt -","- C92 H140 Cl4 Fe4 P8 Pt4 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0187","0.0176","","","0.0368","0.0371","","","","","","0.872","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079386","10.4386","0.0004","15.8857","0.0007","16.7485","0.0008","70.586","0.001","71.854","0.002","86.595","0.002","2486.11","0.19","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C26 H38 P2 Pt -","- C26 H38 P2 Pt -","- C104 H152 P8 Pt4 -","4","4","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0427","0.0342","","","0.0713","0.0765","","","","","","1.065","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079387","8.7104","0.0003","12.5809","0.0004","20.3999","0.0007","90","","90","","90","","2235.52","0.13","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H33 Cl P2 Pt -","- C20 H33 Cl P2 Pt -","- C80 H132 Cl4 P8 Pt4 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0182","0.0171","","","0.0396","0.0401","","","","","","0.951","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079388","12.2108","0.0005","13.9863","0.0006","16.1809","0.0007","90","","90","","90","","2763.4","0.2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H37 Cl Fe P2 Pt -","- C28 H37 Cl Fe P2 Pt -","- C112 H148 Cl4 Fe4 P8 Pt4 -","4","1","","Guino-o, Marites A.; Zureick, Andrew H.; Blank, Natalia F.; Anderson, Brian J.; Chapp, Timothy W.; Kim, Youngmin; Glueck, David S.; Rheingold, Arnold L.","Synthesis and Structure of Platinum Bis(phospholane) Complexes Pt(diphos*)(R)(X), Catalyst Precursors for Asymmetric Phosphine Alkylation","Organometallics","2012","31","19","6900","","10.1021/om300704e","","","0.71073","MoKα","","0.0396","0.033","","","0.0715","0.0742","","","","","","1.044","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079389","14.8407","0.0005","15.1053","0.0005","18.7324","0.0007","87.778","0.001","89.739","0.001","83.582","0.001","4169.8","0.3","153","2","153","1","","","","","","","","6","P -1","-P 1","2","","","","- C32 H69 Al2 Li O6.25 Ru2 -","- C31.999 H68.61 Al2 Li O6.247 Ru2 -","- C127.996 H274.44 Al8 Li4 O24.988 Ru8 -","4","2","","Plois, Markus; Wiegand, Thomas; Wolf, Robert","Novel Ruthenium(II) Aluminate Anions: Building Blocks of Unique Cage Structures","Organometallics","2012","31","24","8469","","10.1021/om300705x","","","0.71073","MoKα","","0.0371","0.0272","","","0.0612","0.0654","","","","","","1.006","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079390","22.3854","0.0008","19.9019","0.0007","21.7509","0.0008","90","","93.43","0.001","90","","9672.9","0.6","153","2","153","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C84 H165 Al4 Li5 O2 Ru6 -","- C84 H165 Al4 Li5 O2 Ru6 -","- C336 H660 Al16 Li20 O8 Ru24 -","4","0.5","","Plois, Markus; Wiegand, Thomas; Wolf, Robert","Novel Ruthenium(II) Aluminate Anions: Building Blocks of Unique Cage Structures","Organometallics","2012","31","24","8469","","10.1021/om300705x","","","0.71073","MoKα","","0.0318","0.0264","","","0.0641","0.0666","","","","","","1.019","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079391","11.5104","0.0005","11.901","0.0005","12.574","0.0006","67.787","0.001","64.653","0.001","69.865","0.001","1406.45","0.11","153","2","153","1","","","","","","","","6","P -1","-P 1","2","","","","- C44 H94 Al4 Li4 O4 Ru2 -","- C44 H94 Al4 Li4 O4 Ru2 -","- C44 H94 Al4 Li4 O4 Ru2 -","1","0.5","","Plois, Markus; Wiegand, Thomas; Wolf, Robert","Novel Ruthenium(II) Aluminate Anions: Building Blocks of Unique Cage Structures","Organometallics","2012","31","24","8469","","10.1021/om300705x","","","0.71073","MoKα","","0.0565","0.0386","","","0.0929","0.1047","","","","","","0.799","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079392","12.593","0.0012","13.4952","0.0013","18.7452","0.0018","90","","105.334","0.001","90","","3072.2","0.5","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H104 Al4 Li4 O4 Ru2 -","- C48 H104 Al4 Li4 O4 Ru2 -","- C96 H208 Al8 Li8 O8 Ru4 -","2","0.5","","Plois, Markus; Wiegand, Thomas; Wolf, Robert","Novel Ruthenium(II) Aluminate Anions: Building Blocks of Unique Cage Structures","Organometallics","2012","31","24","8469","","10.1021/om300705x","","","0.71073","MoKα","","0.0552","0.0367","","","0.0943","0.1026","","","","","","1.043","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079393","9.966","0.0013","12.9095","0.0016","13.849","0.0017","70.246","0.002","83.665","0.002","86.005","0.002","1665.7","0.4","218","2","218","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H112 Al4 Li4 O4 Ru2 -","- C52 H112 Al4 Li4 O4 Ru2 -","- C52 H112 Al4 Li4 O4 Ru2 -","1","0.5","","Plois, Markus; Wiegand, Thomas; Wolf, Robert","Novel Ruthenium(II) Aluminate Anions: Building Blocks of Unique Cage Structures","Organometallics","2012","31","24","8469","","10.1021/om300705x","","","0.71073","MoKα","","0.0486","0.0396","","","0.1088","0.1168","","","","","","1.029","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079394","15.79","0.003","10.083","0.002","21.042","0.004","90","","106.49","0.03","90","","3212.3","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H30 Co F6 P -","- C40 H30 Co F6 P -","- C160 H120 Co4 F24 P4 -","4","1","","Dabek, Sven; Prosenc, Marc Heinrich; Heck, Jürgen","Dipolar Sesquifulvalene Compounds with (Tetraaryl-η4-cyclobutadiene)(η5- cyclopentadienediyl)cobalt(I) Complex Units as Electron Donors","Organometallics","2012","31","19","6911","","10.1021/om300710x","","","0.71073","MoKα","","0.0724","0.0446","","","0.0964","0.1075","","","","","","1.013","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079395","11.969","0.002","12.806","0.003","13.689","0.003","86.24","0.03","79.13","0.03","88.55","0.03","2055.9","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H42 Cl2 Co F6 P -","- C47 H42 Cl2 Co F6 P -","- C94 H84 Cl4 Co2 F12 P2 -","2","1","","Dabek, Sven; Prosenc, Marc Heinrich; Heck, Jürgen","Dipolar Sesquifulvalene Compounds with (Tetraaryl-η4-cyclobutadiene)(η5- cyclopentadienediyl)cobalt(I) Complex Units as Electron Donors","Organometallics","2012","31","19","6911","","10.1021/om300710x","","","0.71073","MoKα","","0.1388","0.0667","","","0.1316","0.1582","","","","","","0.936","","","","has coordinates,has disorder","178682","2020-10-21","18:00:00",""
"4079396","9.6762","0.0002","17.4964","0.0004","9.9031","0.0002","90","","115.002","0.001","90","","1519.47","0.06","193","2","193","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C36 H26 Cu2 N4 S2 -","- C36 H26 Cu2 N4 S2 -","- C72 H52 Cu4 N8 S4 -","2","0.5","","Chen, Chaohuang; Weng, Zhiqiang; Hartwig, John F.","Synthesis of Copper(I) Thiolate Complexes in the Thioetherification of Aryl Halides.","Organometallics","2012","31","22","8031","8037","10.1021/om300711c","","","0.71073","MoKα","","0.0367","0.0279","","","0.072","0.0761","","","","","","1.026","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079397","19.072","0.003","19.072","0.003","54.419","0.016","90","","90","","120","","17142","6","193","2","193","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C130 H122 Cu4 K2 N12 O S6 -","- C130 H122 Cu4 K2 N12 O S6 -","- C780 H732 Cu24 K12 N72 O6.00001 S36 -","6","0.333333","","Chen, Chaohuang; Weng, Zhiqiang; Hartwig, John F.","Synthesis of Copper(I) Thiolate Complexes in the Thioetherification of Aryl Halides.","Organometallics","2012","31","22","8031","8037","10.1021/om300711c","","","0.71073","MoKα","","0.0697","0.0381","","","0.0922","0.1019","","","","","","0.971","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079398","13.8442","0.0009","17.2651","0.0011","16.271","0.001","90","","98.546","0.001","90","","3845.9","0.4","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H44 Ge2 P2 Pt -","- C41 H44 Ge2 P2 Pt -","- C164 H176 Ge8 P8 Pt4 -","4","1","","Arii, Hidekazu; Hashimoto, Rei; Mochida, Kunio; Kawashima, Takayuki","Syntheses of Di- and Trinuclear Platinum Complexes with Multibridged Germanium Centers Derived from Unsymmetrical Digermanes","Organometallics","2012","31","18","6635","","10.1021/om3007147","","","0.71073","MoKα","","0.027","0.021","","","0.0437","0.0453","","","","","","1.026","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079399","9.9454","0.0011","25.845","0.003","12.3586","0.0013","90","","106.687","0.001","90","","3042.9","0.6","123","","123","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C67 H68 Ge3 P4 Pt2 -","- C67 H68 Ge3 P4 Pt2 -","- C134 H136 Ge6 P8 Pt4 -","2","0.5","","Arii, Hidekazu; Hashimoto, Rei; Mochida, Kunio; Kawashima, Takayuki","Syntheses of Di- and Trinuclear Platinum Complexes with Multibridged Germanium Centers Derived from Unsymmetrical Digermanes","Organometallics","2012","31","18","6635","","10.1021/om3007147","","","0.71073","MoKα","","0.0334","0.0276","","","0.0622","0.0646","","","","","","1.054","","","","has coordinates","178682","2020-10-21","18:00:00",""
"4079400","11.7251","0.0015","24.701","0.003","11.8731","0.0015","90","","113.173","0.002","90","","3161.3","0.7","123","","123","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C70 H74 Ge3 P4 Pt2 -","- C70 H74 Ge3 P4 Pt2 -","- C140 H148 Ge6 P8 Pt4 -","2","0.5","","Arii, Hidekazu; Hashimoto, Rei; Mochida, Kunio; Kawashima, Takayuki","Syntheses of Di- and Trinuclear Platinum Complexes with Multibridged Germanium Centers Derived from Unsymmetrical Digermanes","Organometallics","2012","31","18","6635","","10.1021/om3007147","","","0.71073","MoKα","","0.0388","0.0265","","","0.0544","0.0579","","","","","","1.027","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079401","14.0094","0.0015","14.8242","0.0016","25.231","0.003","82.319","0.001","76.68","0.001","64.661","0.001","4604.7","0.9","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C102 H106 Ge3 P6 Pt3 -","- C102 H106 Ge3 P6 Pt3 -","- C204 H212 Ge6 P12 Pt6 -","2","1","","Arii, Hidekazu; Hashimoto, Rei; Mochida, Kunio; Kawashima, Takayuki","Syntheses of Di- and Trinuclear Platinum Complexes with Multibridged Germanium Centers Derived from Unsymmetrical Digermanes","Organometallics","2012","31","18","6635","","10.1021/om3007147","","","0.71073","MoKα","","0.0424","0.0371","","","0.0886","0.0909","","","","","","1.079","","","","has coordinates","295947","2024-11-15","22:25:06",""
"4079402","14.8891","0.0016","15.1772","0.0016","47.112","0.005","90","","97.119","0.001","90","","10564.1","1.9","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C116 H108 Ge P8 Pt4 -","- C116 H108 Ge P8 Pt4 -","- C464 H432 Ge4 P32 Pt16 -","4","1","","Arii, Hidekazu; Hashimoto, Rei; Mochida, Kunio; Kawashima, Takayuki","Syntheses of Di- and Trinuclear Platinum Complexes with Multibridged Germanium Centers Derived from Unsymmetrical Digermanes","Organometallics","2012","31","18","6635","","10.1021/om3007147","","","0.71073","MoKα","","0.0666","0.0572","","","0.135","0.1397","","","","","","1.071","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079403","11.8772","0.0012","12.1298","0.0012","12.4458","0.0012","99.166","0.001","115.536","0.001","91.197","0.001","1589.1","0.3","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H31 Br Cl2 P2 -","- C35 H31 Br Cl2 P2 -","- C70 H62 Br2 Cl4 P4 -","2","1","","Hussain, Riaz; Fowler, Kevin G.; Sauriol, Francoise; Baird, Michael C.; Budzelaar, Peter H. M.","Synthesis and Ruthenium Coordination Complexes of the Chelating Phosphine Phosphonium-1-indenylide 1,1-Bis(diphenylphosphino)methane-1-indenylide,1-C9H6Ph2PCH2PPh2","Organometallics","2012","31","19","6926","","10.1021/om300715a","","","0.71073","MoKα","","0.031","0.0269","","","0.0705","0.0727","","","","","","1.046","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079404","10.9216","0.0005","11.6984","0.0005","12.2897","0.0005","94.046","0.004","114.453","0.003","105.143","0.003","1350.89","0.11","180","2","180","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H28 P2 -","- C34 H28 P2 -","- C68 H56 P4 -","2","1","","Hussain, Riaz; Fowler, Kevin G.; Sauriol, Francoise; Baird, Michael C.; Budzelaar, Peter H. M.","Synthesis and Ruthenium Coordination Complexes of the Chelating Phosphine Phosphonium-1-indenylide 1,1-Bis(diphenylphosphino)methane-1-indenylide,1-C9H6Ph2PCH2PPh2","Organometallics","2012","31","19","6926","","10.1021/om300715a","","","0.71073","MoKα","","0.0758","0.0495","","","0.1119","0.1286","","","","","","1.052","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079405","14.205","0.005","13.076","0.005","56.49","0.02","90","","96.721","0.007","90","","10421","7","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C138 H117 Cl2 N2 P Ru -","- C138 H117 Cl2 N2 P Ru -","- C552 H468 Cl8 N8 P4 Ru4 -","4","1","","Manzini, Simone; Urbina Blanco, César A.; Slawin, Alexandra M. Z.; Nolan, Steven P.","Effect of Ligand Bulk in Ruthenium-Catalyzed Olefin Metathesis: IPr* vs IPr","Organometallics","2012","31","18","6514","","10.1021/om300719t","","","0.71075","MoKα","","","0.1527","","","","0.2984","","","","","","1.231","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079406","44.082","0.005","44.082","0.005","22.826","0.003","90","","90","","120","","38413","8","93","","93","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C89 H71 Cl2 N3 Ru -","- C89 H71 Cl2 N3 Ru -","- C1602 H1278 Cl36 N54 Ru18 -","18","1","","Manzini, Simone; Urbina Blanco, César A.; Slawin, Alexandra M. Z.; Nolan, Steven P.","Effect of Ligand Bulk in Ruthenium-Catalyzed Olefin Metathesis: IPr* vs IPr","Organometallics","2012","31","18","6514","","10.1021/om300719t","","","0.71075","MoKα","","","0.1234","","","","0.3644","","","","","","1.229","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079407","12.4832","0.0019","19.696","0.003","20.977","0.004","90","","96.841","0.003","90","","5120.9","1.5","93","","93","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C60 H61 Cl2 N2 P Ru -","- C60 H61 Cl2 N2 P Ru -","- C240 H244 Cl8 N8 P4 Ru4 -","4","2","","Manzini, Simone; Urbina Blanco, César A.; Slawin, Alexandra M. Z.; Nolan, Steven P.","Effect of Ligand Bulk in Ruthenium-Catalyzed Olefin Metathesis: IPr* vs IPr","Organometallics","2012","31","18","6514","","10.1021/om300719t","","","0.71075","MoKα","","","0.0768","","","","0.1813","","","","","","1.122","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079408","12.73","0.003","20.795","0.005","15.631","0.004","90","","93.758","0.003","90","","4128.9","1.7","93","","93","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47 H51 Cl2 N3 Ru -","- C47 H51 Cl2 N3 Ru -","- C188 H204 Cl8 N12 Ru4 -","4","1","","Manzini, Simone; Urbina Blanco, César A.; Slawin, Alexandra M. Z.; Nolan, Steven P.","Effect of Ligand Bulk in Ruthenium-Catalyzed Olefin Metathesis: IPr* vs IPr","Organometallics","2012","31","18","6514","","10.1021/om300719t","","","0.71075","MoKα","","","0.0561","","","","0.1629","","","","","","0.804","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079409","20.3668","0.0019","7.8505","0.0007","18.4305","0.0017","90","","113.018","0.002","90","","2712.2","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H13 Br N2 O Pd -","- C14 H13 Br N2 O Pd -","- C112 H104 Br8 N16 O8 Pd8 -","8","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0191","0.0183","","","0.0462","0.0466","","","","","","1.075","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079410","10.0709","0.0007","15.5194","0.0011","22.5797","0.0016","90","","90","","90","","3529.1","0.4","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H19 Cl N2 O4 Pd -","- C17 H19 Cl N2 O4 Pd -","- C136 H152 Cl8 N16 O32 Pd8 -","8","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0312","0.0295","","","0.0606","0.0614","","","","","","1.15","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079411","10.8421","0.0009","19.6837","0.0017","15.0237","0.0013","90","","92.141","0.002","90","","3204","0.5","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H34 Cl N2 O5 P Pd -","- C35 H34 Cl N2 O5 P Pd -","- C140 H136 Cl4 N8 O20 P4 Pd4 -","4","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0331","0.0323","","","0.0717","0.0722","","","","","","1.175","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079412","9.3813","0.0012","10.4728","0.0013","11.4417","0.0014","72.852","0.002","74.904","0.002","77.015","0.002","1023.7","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H21 Cl N2 O5 Pd S -","- C19 H21 Cl N2 O5 Pd S -","- C38 H42 Cl2 N4 O10 Pd2 S2 -","2","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0248","0.0232","","","0.0561","0.057","","","","","","1.088","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079413","10.2779","0.0008","12.5537","0.0011","15.3386","0.0012","100.811","0.002","107.447","0.002","103.935","0.002","1758.9","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C32 H31 Cl2 F3 N4 O7 Pd2 S -","- C32 H31 Cl2 F3 N4 O7 Pd2 S -","- C64 H62 Cl4 F6 N8 O14 Pd4 S2 -","2","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0239","0.0225","","","0.054","0.0548","","","","","","1.085","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079414","8.3594","0.0008","17.8281","0.0017","14.2296","0.0013","90","","104.731","0.002","90","","2051","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Cl N3 O Pd -","- C23 H22 Cl N3 O Pd -","- C92 H88 Cl4 N12 O4 Pd4 -","4","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0286","0.0253","","","0.058","0.0595","","","","","","1.042","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079415","10.2224","0.0006","10.3319","0.0006","11.0733","0.0006","62.387","0.002","82.022","0.002","72.919","0.002","990.6","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H19 Cl N2 O5 Pd -","- C20 H19 Cl N2 O5 Pd -","- C40 H38 Cl2 N4 O10 Pd2 -","2","1","","Abellán-López, Antonio; Chicote, María-Teresa; Bautista, Delia; Vicente, José","From ChelateC,N-Cyclopalladated Oximes toC,N,N′-,C,N,S-, orC,N,C′-Pincer Palladium(II) Complexes by Formation of Oxime Ether Ligands","Organometallics","2012","31","21","7434","","10.1021/om3007213","","","0.71073","MoKα","","0.0235","0.0225","","","0.0555","0.056","","","","","","1.085","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079416","18.108","0.003","19.588","0.003","37.948","0.005","90","","90","","90","","13460","4","93","2","93","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C75 H61 Cl6 N3 Pd -","- C75 H61 Cl6 N3 Pd -","- C600 H488 Cl48 N24 Pd8 -","8","1","","Chartoire, Anthony; Frogneux, Xavier; Boreux, Arnaud; Slawin, Alexandra M. Z.; Nolan, Steven P.","[Pd(IPr*)(3-Cl-pyridinyl)Cl2]: A Novel and Efficient PEPPSI Precatalyst","Organometallics","2012","31","19","6947","","10.1021/om300725f","","","0.71073","MoKα","","0.1312","0.0951","","","0.2578","0.2944","","","","","","1.016","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079417","10.0228","0.0004","12.6787","0.0005","12.7306","0.0005","116.493","0.004","97.845","0.003","104.747","0.004","1340.47","0.12","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H28 Fe N O2 P S2 -","- C30 H28 Fe N O2 P S2 -","- C60 H56 Fe2 N2 O4 P2 S4 -","2","1","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.0311","0.0249","","","0.0643","0.0663","","","","","","1.038","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079418","11.8165","0.0005","13.9301","0.0004","23.5141","0.0008","90","","95.8","0.003","90","","3850.7","0.2","180","2","180","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C81 H86 Cl6 Fe2 N2 O4 P2 Ru2 S2 -","- C81 H86 Cl6 Fe2 N2 O4 P2 Ru2 S2 -","- C162 H172 Cl12 Fe4 N4 O8 P4 Ru4 S4 -","2","0.5","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.0364","0.0266","","","0.063","0.0664","","","","","","1.034","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079419","9.9385","0.0003","19.6894","0.0005","10.2648","0.0003","90","","98.824","0.003","90","","1984.87","0.1","180","2","180","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C41 H45 Cl4 Fe N O2 P Rh S -","- C41 H45 Cl4 Fe N O2 P Rh S -","- C82 H90 Cl8 Fe2 N2 O4 P2 Rh2 S2 -","2","1","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.0341","0.0311","","","0.071","0.0731","","","","","","1.026","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079420","10.1408","0.0005","14.7064","0.0006","33.421","0.003","90","","90","","90","","4984.2","0.5","180","2","180","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C41 H45 Cl2 Fe N O2 P Rh S -","- C41 H45 Cl2 Fe N O2 P Rh S -","- C164 H180 Cl8 Fe4 N4 O8 P4 Rh4 S4 -","4","1","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.1017","0.0793","","","0.1789","0.1903","","","","","","1.074","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079421","9.9185","0.0002","19.7296","0.0004","10.2736","0.0002","90","","98.624","0.002","90","","1987.69","0.07","180","2","180","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C41 H45 Cl4 Fe Ir N O2 P S -","- C41 H45 Cl4 Fe Ir N O2 P S -","- C82 H90 Cl8 Fe2 Ir2 N2 O4 P2 S2 -","2","1","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.0285","0.0261","","","0.0517","0.0528","","","","","","1.042","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079422","10.0011","0.0002","22.5752","0.0004","17.2737","0.0003","90","","95.006","0.002","90","","3885.12","0.12","180","2","180","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C41 H44 Cl3 Fe Ir N O2 P S -","- C41 H44 Cl3 Fe Ir N O2 P S -","- C164 H176 Cl12 Fe4 Ir4 N4 O8 P4 S4 -","4","1","","Wei, Muh-Mei; Garc\?ía-Melchor, Max; Daran, Jean-Claude; Audin, Catherine; Lledós, Agustí; Poli, Rinaldo; Deydier, Eric; Manoury, Eric","Coordination Chemistry of New Chiral P,N Ferrocenyl Ligands with Half-Sandwich Ruthenium(II), Rhodium(III), and Iridium(III) Complexes","Organometallics","2012","31","18","6669","","10.1021/om300738q","","","0.71073","MoKα","","0.0449","0.0328","","","0.0699","0.0751","","","","","","1.046","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079423","20.4859","0.0014","20.5346","0.0013","21.81","0.002","98.585","0.005","106.028","0.005","116.8","0.003","7459.4","1.1","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C132 H92 Al2 Cl4 Cr2 F72 N4 O8 P8 -","- C132 H92 Al2 Cl4 Cr2 F72 N4 O8 P8 -","- C264 H184 Al4 Cl8 Cr4 F144 N8 O16 P16 -","2","1","","Stennett, Tom E.; Haddow, Mairi F.; Wass, Duncan F.","Avoiding MAO: Alternative Activation Methods in Selective Ethylene Oligomerization","Organometallics","2012","31","19","6960","","10.1021/om300739m","","","0.71073","MoKα","","0.1572","0.0744","","","0.1617","0.1998","","","","","","1.026","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079424","19.9277","0.0005","30.3587","0.0007","13.5975","0.0003","90","","90","","90","","8226.2","0.3","100","2","100","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C76 H48 Al Cl2 Cr F36 O4 P4 -","- C76 H48 Al Cl2 Cr F36 O4 P4 -","- C304 H192 Al4 Cl8 Cr4 F144 O16 P16 -","4","0.5","","Stennett, Tom E.; Haddow, Mairi F.; Wass, Duncan F.","Avoiding MAO: Alternative Activation Methods in Selective Ethylene Oligomerization","Organometallics","2012","31","19","6960","","10.1021/om300739m","","","0.71073","MoKα","","0.095","0.0663","","","0.1641","0.1839","","","","","","1.024","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079425","18.9938","0.0007","26.2607","0.001","26.82","0.0011","101.273","0.002","96.016","0.002","109.868","0.002","12124","0.8","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C198 H148 Al2 Cl2 Cr2 F144 N4 O32 P8 -","- C198 H148 Al4 Cl2 Cr2 F144 N4 O32 P8 -","- C396 H296 Al8 Cl4 Cr4 F288 N8 O64 P16 -","2","1","","Stennett, Tom E.; Haddow, Mairi F.; Wass, Duncan F.","Avoiding MAO: Alternative Activation Methods in Selective Ethylene Oligomerization","Organometallics","2012","31","19","6960","","10.1021/om300739m","","","0.71073","MoKα","","0.151","0.1177","","","0.3096","0.3458","","","","","","1.025","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079426","7.623","0.0008","9.628","0.0017","11.667","0.001","91.53","0.009","108.049","0.004","109.394","0.011","759.9","0.18","198","","198","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 I N2 S -","- C16 H13 I N2 S -","- C32 H26 I2 N4 S2 -","2","1","","Tronnier, Alexander; Risler, Anita; Langer, Nicolle; Wagenblast, Gerhard; Münster, Ingo; Strassner, Thomas","A Phosphorescent C∧C* Cyclometalated Platinum(II) Dibenzothiophene NHC Complex","Organometallics","2012","31","21","7447","","10.1021/om300740d","","x-ray","0.71073","MoKα","","0.0405","0.0233","","","0.0555","0.0588","","","","","","1.142","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079427","10.698","0.0011","12.719","0.0013","13.575","0.0014","90","","93.332","0.009","90","","1844","0.3","198","","198","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N2 O2 Pt S -","- C21 H18 N2 O2 Pt S -","- C84 H72 N8 O8 Pt4 S4 -","4","1","","Tronnier, Alexander; Risler, Anita; Langer, Nicolle; Wagenblast, Gerhard; Münster, Ingo; Strassner, Thomas","A Phosphorescent C∧C* Cyclometalated Platinum(II) Dibenzothiophene NHC Complex","Organometallics","2012","31","21","7447","","10.1021/om300740d","","x-ray","0.71073","MoKα","","0.0809","0.033","","","0.05","0.0572","","","","","","1.058","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079428","10.9969","0.0005","14.8174","0.0006","14.7423","0.0006","90","","109.878","0.002","90","","2259.07","0.17","103","2","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H39 N O Si W -","- C21 H39 N O Si W -","- C84 H156 N4 O4 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.02","0.0165","","","0.0372","0.0383","","","","","","1.017","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079429","15.367","0.005","9.883","0.003","30.526","0.009","90","","103.876","0.01","90","","4501","2","103","2","103","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19 H36 N O P Si W -","- C19 H36 N O P Si W -","- C152 H288 N8 O8 P8 Si8 W8 -","8","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.0269","0.0211","","","0.0416","0.0434","","","","","","1.039","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079430","22.9694","0.0008","9.2914","0.0004","21.8178","0.0008","90","","96.48","0.002","90","","4626.6","0.3","103","2","103","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H37 N O Si W -","- C22 H37 N O Si W -","- C176 H296 N8 O8 Si8 W8 -","8","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.022","0.018","","","0.0365","0.0375","","","","","","1.046","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079431","12.1444","0.0003","11.495","0.0004","17.3264","0.0006","90","","104.265","0.001","90","","2344.18","0.13","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H39 N O2 Si W -","- C22 H39 N O2 Si W -","- C88 H156 N4 O8 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.0241","0.0204","","","0.0521","0.0539","","","","","","1.043","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079432","11.045","0.002","14.93","0.003","14.878","0.003","90","","109.992","0.005","90","","2305.6","0.8","278","2","278","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H39 Mo N O Si -","- C21 H39 Mo N O Si -","- C84 H156 Mo4 N4 O4 Si4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.0721","0.0361","","","0.0724","0.084","","","","","","0.991","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079433","15.4189","0.0013","9.9407","0.0008","30.681","0.003","90","","103.953","0.004","90","","4563.9","0.7","103","2","103","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19 H36 Mo N O P Si -","- C19 H36 Mo N O P Si -","- C152 H288 Mo8 N8 O8 P8 Si8 -","8","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Intermolecular C‒H Activations of Hydrocarbons Initiated by a Tungsten Trimethylsilylallyl Complex","Organometallics","2012","31","21","7453","","10.1021/om300742y","","","0.71073","MoKα","","0.058","0.0362","","","0.0669","0.0734","","","","","","1.02","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079434","10.22","0.0018","11.454","0.002","16.325","0.003","96.948","0.002","92.494","0.002","108.046","0.003","1797","0.6","110","2","110","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C36 H44 B Cl2 F4 Mo2 P S -","- C36 H44 B Cl2 F4 Mo2 P S -","- C72 H88 B2 Cl4 F8 Mo4 P2 S2 -","2","1","","Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Menéndez, Sonia; Ruiz, Miguel A.","Reversible P‒C Coupling Reactions at the Unsaturated Dimolybdenum Carbyne Complex [Mo2(η5-C5H5)2(CPh)(μ-PCy2)(μ-SPh)(CO)]+","Organometallics","2012","31","20","7181","","10.1021/om300743q","","x-ray","0.71073","MoKα","","0.0851","0.0544","","","0.1279","0.1379","","","","","","1.017","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079435","11.8512","0.0004","17.6687","0.0005","18.4243","0.0005","90","","96.582","0.002","90","","3832.5","0.2","100","0.1","100","0.1","","","","","","","synthesis as described","9","P 1 21/c 1","-P 2ybc","14","","","","- C37 H46 B Cl2 F4 Mo2 O2 P S -","- C37 H46 B Cl2 F4 Mo2 O2 P S -","- C148 H184 B4 Cl8 F16 Mo8 O8 P4 S4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Menéndez, Sonia; Ruiz, Miguel A.","Reversible P‒C Coupling Reactions at the Unsaturated Dimolybdenum Carbyne Complex [Mo2(η5-C5H5)2(CPh)(μ-PCy2)(μ-SPh)(CO)]+","Organometallics","2012","31","20","7181","","10.1021/om300743q","","x-ray","0.71073","MoKα","","0.0514","0.0337","","","0.0678","0.0734","","","","","","1.058","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079436","17.9615","0.0011","18.9579","0.0011","26.2634","0.0011","90","","131.147","0.003","90","","6734.3","0.7","100","0.1","100","0.1","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C70 H54 B F24 Mo2 O3 P S -","- C70 H54 B F24 Mo2 O3 P S -","- C280 H216 B4 F96 Mo8 O12 P4 S4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Menéndez, Sonia; Ruiz, Miguel A.","Reversible P‒C Coupling Reactions at the Unsaturated Dimolybdenum Carbyne Complex [Mo2(η5-C5H5)2(CPh)(μ-PCy2)(μ-SPh)(CO)]+","Organometallics","2012","31","20","7181","","10.1021/om300743q","","x-ray","0.71073","MoKα","","0.209","0.093","","","0.1437","0.1929","","","","","","1.025","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079437","15.0578","0.0002","11.5827","0.0002","19.9833","0.0003","90","","103.279","0.001","90","","3392.1","0.09","100","","100","2","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C37 H42 B F4 Mo2 O2 P S -","- C37 H42 B F4 Mo2 O2 P S -","- C148 H168 B4 F16 Mo8 O8 P4 S4 -","4","1","","Alvarez, M. Angeles; García, M. Esther; García-Vivó, Daniel; Menéndez, Sonia; Ruiz, Miguel A.","Reversible P‒C Coupling Reactions at the Unsaturated Dimolybdenum Carbyne Complex [Mo2(η5-C5H5)2(CPh)(μ-PCy2)(μ-SPh)(CO)]+","Organometallics","2012","31","20","7181","","10.1021/om300743q","","x-ray","1.54184","CuKα","","0.0574","0.0491","","","0.1231","0.1296","","","","","","1.017","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079438","6.194","0.0012","12.771","0.003","15.952","0.003","90","","99.188","0.005","90","","1245.7","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 Cr N -","- C14 H17 Cr N -","- C56 H68 Cr4 N4 -","4","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0522","0.0373","","","0.0836","0.0894","","","","","","1.025","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079439","14.8173","0.0005","9.6377","0.0003","15.6977","0.0006","90","","90","","90","","2241.71","0.13","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C28 H27 Cr N -","- C28 H27 Cr N -","- C112 H108 Cr4 N4 -","4","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0513","0.0361","","","0.0702","0.0766","","","","","","1.022","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079440","11.8637","0.0005","14.0753","0.0006","12.0754","0.0005","90","","100.629","0.002","90","","1981.81","0.14","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 Cr N O -","- C23 H28 Cr N O -","- C92 H112 Cr4 N4 O4 -","4","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71069","MoKα","","0.078","0.0477","","","0.103","0.1173","","","","","","1.037","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079441","6.6572","0.0001","8.0888","0.0002","31.8456","0.0007","90","","90","","90","","1714.85","0.06","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 Cr N S -","- C20 H22 Cr N S -","- C80 H88 Cr4 N4 S4 -","4","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0376","0.0329","","","0.0757","0.0778","","","","","","1.104","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079442","8.866","0.002","14.856","0.003","8.982","0.002","90","","96.725","0.004","90","","1174.9","0.4","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H27 Cr I N -","- C28 H27 Cr I N -","- C56 H54 Cr2 I2 N2 -","2","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0599","0.0447","","","0.1","0.1074","","","","","","1.019","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079443","8.6032","0.0005","9.9332","0.0005","11.8898","0.0006","70.311","0.002","77.289","0.002","66.086","0.002","870.42","0.08","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H24 Cr N -","- C21 H24 Cr N -","- C42 H48 Cr2 N2 -","2","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0475","0.0347","","","0.082","0.0874","","","","","","1.055","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079444","15.458","0.002","9.149","0.0013","14.479","0.002","90","","90","","90","","2047.7","0.5","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C24 H31 Cr2 N -","- C24 H31 Cr2 N -","- C96 H124 Cr8 N4 -","4","1","","MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Oxidatively Induced Reductive Elimination from a Chromium(III) Bis(aryl) Complex","Organometallics","2012","31","18","6681","","10.1021/om300751z","","","0.71073","MoKα","","0.0478","0.0344","","","0.0627","0.0667","","","","","","1.018","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079445","11.5829","0.0005","15.5446","0.0007","17.2558","0.0008","63.609","0.002","81.434","0.003","71.135","0.002","2633.6","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H26 N4 Pd -","- C18 H26 N4 Pd -","- C108 H156 N24 Pd6 -","6","3","","Tang, Fengzhi; Zhang, Ying; Rath, Nigam P.; Mirica, Liviu M.","Detection of Pd(III) and Pd(IV) Intermediates during the Aerobic Oxidative C‒C Bond Formation from a Pd(II) Dimethyl Complex","Organometallics","2012","31","18","6690","","10.1021/om300752w","","","0.71073","MoKα","","0.0484","0.0297","","","0.0549","0.0606","","","","","","1.01","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079446","14.2427","0.0015","12.4519","0.0013","11.2446","0.0011","90","","90","","90","","1994.2","0.4","100","2","100","2","","","","","","","","5","I m a 2","I 2 -2a","46","","","","- C19 H29 I N4 Pd -","- C19 H29 I N4 Pd -","- C76 H116 I4 N16 Pd4 -","4","0.5","","Tang, Fengzhi; Zhang, Ying; Rath, Nigam P.; Mirica, Liviu M.","Detection of Pd(III) and Pd(IV) Intermediates during the Aerobic Oxidative C–C Bond Formation from a Pd(II) Dimethyl Complex","Organometallics","2012","31","18","6690","","10.1021/om300752w","","","0.71073","MoKα","","0.028","0.0243","","","0.053","0.0544","","","","","","1.019","","","","has coordinates","288505","2023-12-22","15:12:01",""
"4079447","16.6441","0.0006","17.5923","0.0006","16.9473","0.0006","90","","109.863","0.0004","90","","4667.1","0.3","88","2","88","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 U -","- C26 H40 U -","- C208 H320 U8 -","8","2","","Webster, Christopher L.; Ziller, Joseph W.; Evans, William J.","Synthesis and CO2 Insertion Reactivity of Allyluranium Metallocene Complexes","Organometallics","2012","31","20","7191","","10.1021/om3007536","","","0.71073","MoKα","","0.0247","0.021","","","0.0502","0.0514","","","","","","1.031","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079448","8.459","0.0008","17.0606","0.0016","16.0282","0.0015","90","","101.371","0.001","90","","2267.7","0.4","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H37 Cl U -","- C24 H37 Cl U -","- C96 H148 Cl4 U4 -","4","1","","Webster, Christopher L.; Ziller, Joseph W.; Evans, William J.","Synthesis and CO2Insertion Reactivity of Allyluranium Metallocene Complexes","Organometallics","2012","31","20","7191","","10.1021/om3007536","","","0.71073","MoKα","","0.0281","0.0214","","","0.0501","0.0527","","","","","","1.023","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079449","8.4244","0.0005","20.0795","0.0012","15.6383","0.001","90","","97.9538","0.0006","90","","2619.9","0.3","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 O4 U -","- C28 H40 O4 U -","- C112 H160 O16 U4 -","4","1","","Webster, Christopher L.; Ziller, Joseph W.; Evans, William J.","Synthesis and CO2Insertion Reactivity of Allyluranium Metallocene Complexes","Organometallics","2012","31","20","7191","","10.1021/om3007536","","","0.71073","MoKα","","0.0179","0.0159","","","0.0388","0.0395","","","","","","1.032","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079450","16.4323","0.0008","14.4904","0.0007","21.0299","0.001","90","","97.6487","0.0005","90","","4962.9","0.4","88","2","88","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H44 U -","- C28 H44 U -","- C224 H352 U8 -","8","1","","Webster, Christopher L.; Ziller, Joseph W.; Evans, William J.","Synthesis and CO2Insertion Reactivity of Allyluranium Metallocene Complexes","Organometallics","2012","31","20","7191","","10.1021/om3007536","","","0.71073","MoKα","","0.0154","0.0136","","","0.0323","0.033","","","","","","1.042","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4079451","10.8748","0.0006","15.8693","0.0013","16.3526","0.0011","90","","91.214","0.005","90","","2821.4","0.3","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Cl2 Li2 N4 O8 P2 Pd2 S2 -","- C52 H62 Cl2 Li2 N4 O8 P2 Pd2 S2 -","- C104 H124 Cl4 Li4 N8 O16 P4 Pd4 S4 -","2","0.5","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0929","0.0533","","","0.1083","0.121","","","","","","0.922","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079452","10.8529","0.0005","12.9377","0.0005","20.5399","0.0011","90","","98.446","0.004","90","","2852.8","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N3 O3 P Pd S -","- C30 H34 N3 O3 P Pd S -","- C120 H136 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.05","0.0349","","","0.0706","0.0747","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079453","14.7264","0.0008","15.5116","0.0008","15.8485","0.0008","73.728","0.004","85.791","0.004","89.685","0.004","3465.5","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C35.25 H40 N3 O5 P Pd S -","- C35.25 H40 N3 O5 P Pd S -","- C141 H160 N12 O20 P4 Pd4 S4 -","4","2","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0816","0.0439","","","0.0781","0.086","","","","","","0.963","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079454","15.8625","0.0006","14.5073","0.0003","22.3982","0.0009","90","","132.939","0.002","90","","3773.4","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 N3 O3 P Pd S -","- C41 H50 N3 O3 P Pd S -","- C164 H200 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0412","0.028","","","0.0569","0.0598","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079455","13.8229","0.0006","13.5851","0.0004","17.0924","0.0007","90","","109.842","0.003","90","","3019.2","0.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 N3 O3 P Pd S -","- C32 H38 N3 O3 P Pd S -","- C128 H152 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.039","0.0287","","","0.0634","0.0673","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079456","33.6384","0.0011","12.4052","0.0005","18.2456","0.0006","90","","108.64","0.002","90","","7214.4","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H51 N2 O4 P Pd S2 -","- C35 H51 N2 O4 P Pd S2 -","- C280 H408 N16 O32 P8 Pd8 S16 -","8","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0432","0.0324","","","0.0664","0.0695","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079457","17.9943","0.0008","11.7637","0.0004","24.813","0.0011","90","","133.528","0.002","90","","3808.2","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 N3 O3 P Pd S -","- C40 H54 N3 O3 P Pd S -","- C160 H216 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0502","0.0353","","","0.0675","0.0712","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079458","17.9735","0.0007","11.2607","0.0003","18.2288","0.0007","90","","94.484","0.003","90","","3678.1","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H50 N3 O3 P Pd S -","- C38 H50 N3 O3 P Pd S -","- C152 H200 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.034","0.0268","","","0.0456","0.0461","","","","","","1.917","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079459","18.0006","0.0007","11.2854","0.0003","24.3809","0.0009","90","","131.405","0.002","90","","3714.9","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H52 N3 O3 P Pd S -","- C39 H52 N3 O3 P Pd S -","- C156 H208 N12 O12 P4 Pd4 S4 -","4","1","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.033","0.0249","","","0.0603","0.0619","","","","","","1.032","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079460","10.6341","0.0007","11.1581","0.0007","13.476","0.0009","78.501","0.005","86.039","0.006","72.151","0.005","1491.44","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H68 N6 O6 P2 Pd2 S2 -","- C63 H68 N6 O6 P2 Pd2 S2 -","- C63 H68 N6 O6 P2 Pd2 S2 -","1","0.5","","Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Göttker-Schnetmann, Inigo; Mecking, Stefan","Controlled Acrylate Insertion Regioselectivity in Diazaphospholidine-Sulfonato Palladium(II) Complexes","Organometallics","2012","31","24","8505","","10.1021/om300755j","","","0.71073","MoKα","","0.0396","0.0316","","","0.0854","0.0871","","","","","","1.202","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079461","23.524","0.014","18.027","0.014","17.301","0.015","90","","125.36","0.02","90","","5983","8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H52 Cl2 N2 O4 Zr -","- C44 H52 Cl2 N2 O4 Zr -","- C176 H208 Cl8 N8 O16 Zr4 -","4","0.5","","Shi, Xiao-Chao; Jin, Guo-Xin","Titanium and Zirconium Catalysts with [N,O] Ligands: Syntheses, Characterization, and Their Catalytic Properties for Olefin Polymerization","Organometallics","2012","31","20","7198","","10.1021/om3007568","","","0.71073","MoKα","","0.1138","0.0716","","","0.1674","0.1867","","","","","","0.916","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079462","23.285","0.004","17.774","0.003","17.224","0.005","90","","125.335","0.002","90","","5815","2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 Cl4 N2 O4 Zr -","- C42 H46 Cl4 N2 O4 Zr -","- C168 H184 Cl16 N8 O16 Zr4 -","4","0.5","","Shi, Xiao-Chao; Jin, Guo-Xin","Titanium and Zirconium Catalysts with [N,O] Ligands: Syntheses, Characterization, and Their Catalytic Properties for Olefin Polymerization","Organometallics","2012","31","20","7198","","10.1021/om3007568","","","0.71073","MoKα","","0.0876","0.0663","","","0.1823","0.1981","","","","","","0.99","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079463","13.905","0.003","15.981","0.004","16.323","0.004","90","","90","","90","","3627.2","1.5","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C37 H38 Cl4 N2 O4 Zr -","- C37 H38 Cl4 N2 O4 Zr -","- C148 H152 Cl16 N8 O16 Zr4 -","4","0.5","","Shi, Xiao-Chao; Jin, Guo-Xin","Titanium and Zirconium Catalysts with [N,O] Ligands: Syntheses, Characterization, and Their Catalytic Properties for Olefin Polymerization","Organometallics","2012","31","20","7198","","10.1021/om3007568","","","0.71073","MoKα","","0.1164","0.1046","","","0.2481","0.2525","","","","","","1.356","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079464","16.2341","0.0004","20.9676","0.0004","17.6475","0.0003","90","","105.982","0.001","90","","5774.9","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H74 Cl2 N2 O4 Zr -","- C60 H74 Cl2 N2 O4 Zr -","- C240 H296 Cl8 N8 O16 Zr4 -","4","1","","Shi, Xiao-Chao; Jin, Guo-Xin","Titanium and Zirconium Catalysts with [N,O] Ligands: Syntheses, Characterization, and Their Catalytic Properties for Olefin Polymerization","Organometallics","2012","31","20","7198","","10.1021/om3007568","","","1.54178","CuKα","","0.0607","0.0504","","","0.141","0.1479","","","","","","1.073","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079465","9.096","0.003","13.328","0.004","14.479","0.004","97.164","0.005","93.365","0.006","96.972","0.006","1723.9","0.9","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H57 Al N4 O2 -","- C35 H57 Al N4 O2 -","- C70 H114 Al2 N8 O4 -","2","1","","Ikpo, Nduka; Barbon, Stephanie M.; Drover, Marcus W.; Dawe, Louise N.; Kerton, Francesca M.","Aluminum Methyl and Chloro Complexes Bearing Monoanionic Aminephenolate Ligands: Synthesis, Characterization, and Use in Polymerizations","Organometallics","2012","31","23","8145","","10.1021/om300757u","","","0.71075","MoKα","","0.054","0.049","","","0.1208","0.1251","","","","","","1.064","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079466","11.663","0.003","13.14","0.004","17.086","0.005","100.407","0.003","108.304","0.004","105.925","0.003","2286.2","1.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H77 Al N4 O2 -","- C48 H77 Al N4 O2 -","- C96 H154 Al2 N8 O4 -","2","1","","Ikpo, Nduka; Barbon, Stephanie M.; Drover, Marcus W.; Dawe, Louise N.; Kerton, Francesca M.","Aluminum Methyl and Chloro Complexes Bearing Monoanionic Aminephenolate Ligands: Synthesis, Characterization, and Use in Polymerizations","Organometallics","2012","31","23","8145","","10.1021/om300757u","","","0.71075","MoKα","","0.0685","0.0615","","","0.1542","0.1605","","","","","","1.068","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079467","19.976","0.004","13.016","0.003","29.35","0.006","90","","90","","90","","7631","3","163","2","163","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C39 H63 Al N2 O4 -","- C39 H63 Al N2 O4 -","- C312 H504 Al8 N16 O32 -","8","1","","Ikpo, Nduka; Barbon, Stephanie M.; Drover, Marcus W.; Dawe, Louise N.; Kerton, Francesca M.","Aluminum Methyl and Chloro Complexes Bearing Monoanionic Aminephenolate Ligands: Synthesis, Characterization, and Use in Polymerizations","Organometallics","2012","31","23","8145","","10.1021/om300757u","","","0.71075","MoKα","","0.2374","0.1224","","","0.2307","0.2881","","","","","","1.038","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079468","17.093","0.005","14.214","0.004","16.467","0.005","90","","95.641","0.003","90","","3981","2","163","2","163","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C41 H62 Al Cl N4 O2 -","- C41 H54 Al Cl N4 O2 -","- C164 H216 Al4 Cl4 N16 O8 -","4","0.5","","Ikpo, Nduka; Barbon, Stephanie M.; Drover, Marcus W.; Dawe, Louise N.; Kerton, Francesca M.","Aluminum Methyl and Chloro Complexes Bearing Monoanionic Aminephenolate Ligands: Synthesis, Characterization, and Use in Polymerizations","Organometallics","2012","31","23","8145","","10.1021/om300757u","","","0.71075","MoKα","","0.0433","0.042","","","0.1216","0.1229","","","","","","1.045","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079469","19.2478","0.0014","19.2478","0.0014","11.0743","0.0017","90","","90","","90","","4102.8","0.8","100","2","100","2","","","","","","","","6","I -4","I -4","82","","","","- C16 H24 Bi Cl N2 Si2 -","- C16 H24 Bi Cl N2 Si2 -","- C128 H192 Bi8 Cl8 N16 Si16 -","8","1","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0115","0.0114","","","0.0289","0.0289","","","","","","1.093","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079470","14.7574","0.0009","12.922","0.0008","26.8696","0.0017","90","","103.133","0.001","90","","4989.9","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 Bi N2 Si2 -","- C24 H29 Bi N2 Si2 -","- C192 H232 Bi8 N16 Si16 -","8","2","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0228","0.0201","","","0.046","0.0468","","","","","","1.053","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079471","10.2537","0.0004","16.7284","0.0006","17.4001","0.0006","109.393","0.001","101.633","0.001","95.509","0.001","2714.21","0.17","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H39 Bi N2 Si2 -","- C26 H39 Bi N2 Si2 -","- C104 H156 Bi4 N8 Si8 -","4","2","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0152","0.0139","","","0.0364","0.0368","","","","","","1.049","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079472","19.0673","0.0009","11.7876","0.0005","19.9582","0.0009","90","","113.246","0.001","90","","4121.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H27 Bi N2 Si2 -","- C17 H27 Bi N2 Si2 -","- C136 H216 Bi8 N16 Si16 -","8","2","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0187","0.0168","","","0.0402","0.0409","","","","","","1.092","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079473","16.8842","0.0006","10.3368","0.0004","18.4159","0.0007","90","","113.004","0.001","90","","2958.51","0.19","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H44 Bi N5 Si2 -","- C25 H44 Bi N5 Si2 -","- C100 H176 Bi4 N20 Si8 -","4","1","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0198","0.0161","","","0.0338","0.0348","","","","","","1.062","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079474","12.3288","0.0012","13.4105","0.0013","16.9898","0.0016","88.095","0.001","85.964","0.002","78.135","0.001","2741.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H35 Bi N4 O Si2 -","- C25 H35 Bi N4 O Si2 -","- C100 H140 Bi4 N16 O4 Si8 -","4","2","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0204","0.0164","","","0.033","0.0339","","","","","","1.025","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079475","24.3481","0.0014","12.9325","0.0008","27.2352","0.0016","90","","114.866","0.001","90","","7780.8","0.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H48 Bi2 N4 S Si4 -","- C32 H48 Bi2 N4 S Si4 -","- C256 H384 Bi16 N32 S8 Si32 -","8","2","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0228","0.017","","","0.0331","0.0344","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079476","18.0698","0.0013","12.2388","0.0009","17.9147","0.0013","90","","106.637","0.002","90","","3796","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 Bi2 N4 Si4 -","- C32 H48 Bi2 N4 Si4 -","- C128 H192 Bi8 N16 Si16 -","4","1","","Nekoueishahraki, Bijan; Samuel, Prinson P.; Roesky, Herbert W.; Stern, Daniel; Matussek, Julia; Stalke, Dietmar","Organobismuth(III) and Dibismuthine Complexes Bearing N,N′-Disubstituted 1,8-Diaminonaphthalene Ligand: Synthesis, Structure, and Reactivity","Organometallics","2012","31","18","6697","","10.1021/om300758s","","","0.71073","MoKα","","0.0247","0.0163","","","0.0347","0.0371","","","","","","1.032","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079477","11.1762","0.001","13.775","0.0007","18.7857","0.001","86.154","0.001","87.253","0.002","66.044","0.002","2636.3","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H66 N4 P2 Si4 Ta2 -","- C48 H66 N4 P2 Si4 Ta2 -","- C96 H132 N8 P4 Si8 Ta4 -","2","1","","Ballmann, Joachim; Pick, Fraser; Castro, Ludovic; Fryzuk, Michael D.; Maron, Laurent","Cleavage of Carbon Monoxide Promoted by a Dinuclear Tantalum Tetrahydride Complex","Organometallics","2012","31","24","8516","","10.1021/om300759p","","","0.71069","MoKα","","0.0317","0.0262","","","0.0679","0.0731","","","","","","1.106","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079478","11.7585","0.001","11.5795","0.0009","37.049","0.003","90","","93.683","0.004","90","","5034.1","0.7","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61 H49 B O P3 Rh -","- C61 H49 B O P3 Rh -","- C244 H196 B4 O4 P12 Rh4 -","4","1","","Kameo, Hajime; Nakazawa, Hiroshi","Synthesis of a Rhodium Complex Featuring the Rh‒H‒B Linkage via a Hydride Migration from Rhodium to Borane: Study on the Electronic Deviation Induced by the Presence of the Boron Moiety","Organometallics","2012","31","21","7476","","10.1021/om300762u","","","0.7107","MoKα","","0.1187","0.0813","","","0.1069","0.1169","","","","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079479","12.6418","0.0005","37.1894","0.0014","22.936","0.001","90","","106.281","0.002","90","","10350.7","0.7","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H51 B Cl2 Ir O P3 -","- C62 H51 B Cl2 Ir O P3 -","- C496 H408 B8 Cl16 Ir8 O8 P24 -","8","2","","Kameo, Hajime; Nakazawa, Hiroshi","Synthesis of a Rhodium Complex Featuring the Rh‒H‒B Linkage via a Hydride Migration from Rhodium to Borane: Study on the Electronic Deviation Induced by the Presence of the Boron Moiety","Organometallics","2012","31","21","7476","","10.1021/om300762u","","","0.7107","MoKα","","0.073","0.0632","","","0.1044","0.1087","","","","","","1.28","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079480","9.4001","0.0004","22.2606","0.0009","22.287","0.0009","90","","92.157","0.002","90","","4660.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H49 B P3 Rh -","- C60 H49 B P3 Rh -","- C240 H196 B4 P12 Rh4 -","4","1","","Kameo, Hajime; Nakazawa, Hiroshi","Synthesis of a Rhodium Complex Featuring the Rh‒H‒B Linkage via a Hydride Migration from Rhodium to Borane: Study on the Electronic Deviation Induced by the Presence of the Boron Moiety","Organometallics","2012","31","21","7476","","10.1021/om300762u","","","0.7107","MoKα","","0.0842","0.0627","","","0.1018","0.1128","","","","","","1.16","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079481","35.4431","0.0013","12.4199","0.0005","14.3911","0.0005","90","","90","","90","","6335","0.4","200.1","","200.1","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C75 H60 O3 P5 Rh3 -","- C75 H60 O3 P5 Rh3 -","- C300 H240 O12 P20 Rh12 -","4","1","","Kameo, Hajime; Nakazawa, Hiroshi","Synthesis of a Rhodium Complex Featuring the Rh‒H‒B Linkage via a Hydride Migration from Rhodium to Borane: Study on the Electronic Deviation Induced by the Presence of the Boron Moiety","Organometallics","2012","31","21","7476","","10.1021/om300762u","","","0.7107","MoKα","","","0.0347","","","","0.0759","","","","","","1.02","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079482","29.8232","0.0018","10.1727","0.0006","15.8503","0.0009","90","","113.733","0.002","90","","4402","0.5","103","2","103","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H33 N O Si W -","- C22 H33 N O Si W -","- C176 H264 N8 O8 Si8 W8 -","8","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Thermal Chemistry of a Tungsten Trimethylsilylallyl Complex in Benzene and Fluorobenzenes","Organometallics","2012","31","23","8159","","10.1021/om300765e","","","0.71073","MoKα","","0.0186","0.0158","","","0.0458","0.0569","","","","","","1.353","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079483","8.4708","0.0007","13.6779","0.0011","19.548","0.0018","90","","97.85","0.005","90","","2243.7","0.3","103","2","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H33 N O Si W -","- C22 H33 N O Si W -","- C88 H132 N4 O4 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Thermal Chemistry of a Tungsten Trimethylsilylallyl Complex in Benzene and Fluorobenzenes","Organometallics","2012","31","23","8159","","10.1021/om300765e","","","0.71073","MoKα","","0.0451","0.031","","","0.0636","0.0673","","","","","","1.069","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079484","8.6761","0.0004","16.4535","0.0008","16.2203","0.0008","90","","95.15","0.002","90","","2306.14","0.19","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H28 F5 N O Si W -","- C22 H28 F5 N O Si W -","- C88 H112 F20 N4 O4 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Thermal Chemistry of a Tungsten Trimethylsilylallyl Complex in Benzene and Fluorobenzenes","Organometallics","2012","31","23","8159","","10.1021/om300765e","","","0.71073","MoKα","","0.0384","0.0262","","","0.0562","0.0597","","","","","","1.041","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079485","11.4956","0.0007","11.1957","0.0006","17.5205","0.0008","90","","97.53","0.004","90","","2235.5","0.2","103","2","103","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H31 F2 N O Si W -","- C22 H31 F2 N O Si W -","- C88 H124 F8 N4 O4 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Thermal Chemistry of a Tungsten Trimethylsilylallyl Complex in Benzene and Fluorobenzenes","Organometallics","2012","31","23","8159","","10.1021/om300765e","","","0.71073","MoKα","","0.0547","0.0323","","","0.0508","0.0558","","","","","","0.997","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079486","8.5346","0.0007","13.7027","0.0011","19.8752","0.0016","90","","95.591","0.004","90","","2313.3","0.3","103","2","103","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H31 F2 N O Si W -","- C22 H31 F2 N O Si W -","- C88 H124 F8 N4 O4 Si4 W4 -","4","1","","Chow, Catherine; Patrick, Brian O.; Legzdins, Peter","Thermal Chemistry of a Tungsten Trimethylsilylallyl Complex in Benzene and Fluorobenzenes","Organometallics","2012","31","23","8159","","10.1021/om300765e","","","0.71073","MoKα","","0.049","0.0337","","","0.0745","0.0802","","","","","","1.03","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079487","33.0114","0.0013","10.8616","0.0005","23.8287","0.0009","90","","100.914","0.002","90","","8389.4","0.6","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H56 Cl1.1 N4 O2.3 Rh -","- C44 H52 Cl1.079 N4 O2.342 Rh -","- C352 H416 Cl8.632 N32 O18.736 Rh8 -","8","1","","Cipot-Wechsler, Judy; Covelli, Danielle; Praetorius, Jeremy M.; Hearns, Nigel; Zenkina, Olena V.; Keske, Eric C.; Wang, Ruiyao; Kennepohl, Pierre; Crudden, Cathleen M.","Synthesis and Characterization of Cationic Rhodium Peroxo Complexes","Organometallics","2012","31","21","7306","","10.1021/om300766x","","","0.71073","MoKα","","0.0642","0.0426","","","0.0939","0.1039","","","","","","1.022","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079488","32.344","0.003","8.6387","0.0008","33.322","0.003","90","","95.251","0.002","90","","9271.4","1.5","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47 H55 F3 N6 O5 Rh S -","- C46 H58 N6 O2 Rh -","- C368 H464 N48 O16 Rh8 -","8","1","","Cipot-Wechsler, Judy; Covelli, Danielle; Praetorius, Jeremy M.; Hearns, Nigel; Zenkina, Olena V.; Keske, Eric C.; Wang, Ruiyao; Kennepohl, Pierre; Crudden, Cathleen M.","Synthesis and Characterization of Cationic Rhodium Peroxo Complexes","Organometallics","2012","31","21","7306","","10.1021/om300766x","","","0.71073","MoKα","","0.097","0.0927","","","0.2139","0.216","","","","","","1.153","","","","has coordinates,has disorder","178683","2020-10-21","18:00:00",""
"4079489","12.4497","0.0009","16.9195","0.0012","29.813","0.002","90","","96.545","0.001","90","","6239","0.8","180","2","180","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C59.5 H81 B Cl3 F4 N6 O2 Rh -","- C58 H78 B F4 N6 O2 Rh -","- C232 H312 B4 F16 N24 O8 Rh4 -","4","1","","Cipot-Wechsler, Judy; Covelli, Danielle; Praetorius, Jeremy M.; Hearns, Nigel; Zenkina, Olena V.; Keske, Eric C.; Wang, Ruiyao; Kennepohl, Pierre; Crudden, Cathleen M.","Synthesis and Characterization of Cationic Rhodium Peroxo Complexes","Organometallics","2012","31","21","7306","","10.1021/om300766x","","","0.71073","MoKα","","0.0822","0.0549","","","0.1376","0.1484","","","","","","1.08","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079490","35.081","0.007","11.577","0.002","19.643","0.004","90","","107.81","0.002","90","","7595","3","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H51 N2 O2 Si W -","- C40 H51 N2 O2 Si W -","- C320 H408 N16 O16 Si8 W8 -","8","1","","Sakaba, Hiroyuki; Oike, Hiroyuki; Arai, Yasuhiro; Kwon, Eunsang","Reactions of Tungsten Acetylide‒Silylene Complexes with Pyridines: Direct Observation of Silylene/Silyl Migration in Tungsten Acetylide and Carbyne/Vinylidene Frameworks","Organometallics","2012","31","23","8172","","10.1021/om300772c","","","0.7107","MoKα","","","0.0239","","","","0.0587","","","","","","1.113","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079491","9.675","0.003","11.977","0.004","15.321","0.005","92.19","0.006","95.119","0.004","91.953","0.005","1765.7","1","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H44 N2 O2 Si2 W -","- C36 H44 N2 O2 Si2 W -","- C72 H88 N4 O4 Si4 W2 -","2","1","","Sakaba, Hiroyuki; Oike, Hiroyuki; Arai, Yasuhiro; Kwon, Eunsang","Reactions of Tungsten Acetylide‒Silylene Complexes with Pyridines: Direct Observation of Silylene/Silyl Migration in Tungsten Acetylide and Carbyne/Vinylidene Frameworks","Organometallics","2012","31","23","8172","","10.1021/om300772c","","","0.7107","MoKα","","","0.0237","","","","0.0672","","","","","","1.005","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079492","14.921","0.002","15.088","0.002","26.873","0.004","90","","94.579","0.003","90","","6030.6","1.4","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C27 H32 Ge Mo N2 O3 Si2 -","- C27 H32 Ge Mo N2 O3 Si2 -","- C216 H256 Ge8 Mo8 N16 O24 Si16 -","8","2","","Leung, Wing-Por; Chiu, Wang-Kin; Mak, Thomas C. W.","Synthesis and Structural Characterization of Metallogermylenes, Cp-Substituted Germylene, and a Germanium(II)-Borane Adduct from Pyridyl-1-azaallyl Germanium(II) Chloride","Organometallics","2012","31","19","6966","","10.1021/om3007739","","","0.71073","MoKα","","0.0422","0.033","","","0.0774","0.0831","","","","","","0.99","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079493","12.853","0.003","10.569","0.003","21.936","0.005","90","","95.73","0.004","90","","2965","1.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 Ge N2 O3 Si2 W -","- C27 H32 Ge N2 O3 Si2 W -","- C108 H128 Ge4 N8 O12 Si8 W4 -","4","1","","Leung, Wing-Por; Chiu, Wang-Kin; Mak, Thomas C. W.","Synthesis and Structural Characterization of Metallogermylenes, Cp-Substituted Germylene, and a Germanium(II)-Borane Adduct from Pyridyl-1-azaallyl Germanium(II) Chloride","Organometallics","2012","31","19","6966","","10.1021/om3007739","","","0.71073","MoKα","","0.0431","0.0311","","","0.075","0.082","","","","","","1.025","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079494","9.922","0.004","13.749","0.005","18.76","0.007","90","","100.549","0.007","90","","2515.9","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 Ge N2 Si2 -","- C24 H32 Ge N2 Si2 -","- C96 H128 Ge4 N8 Si8 -","4","1","","Leung, Wing-Por; Chiu, Wang-Kin; Mak, Thomas C. W.","Synthesis and Structural Characterization of Metallogermylenes, Cp-Substituted Germylene, and a Germanium(II)-Borane Adduct from Pyridyl-1-azaallyl Germanium(II) Chloride","Organometallics","2012","31","19","6966","","10.1021/om3007739","","","0.71073","MoKα","","0.0529","0.0373","","","0.0961","0.1073","","","","","","1.058","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079495","19.85","0.006","13.056","0.004","16.452","0.005","90","","110.645","0.005","90","","3990","2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C37 H27 B Cl F15 Ge N2 Si2 -","- C37 H27 B Cl F15 Ge N2 Si2 -","- C148 H108 B4 Cl4 F60 Ge4 N8 Si8 -","4","1","","Leung, Wing-Por; Chiu, Wang-Kin; Mak, Thomas C. W.","Synthesis and Structural Characterization of Metallogermylenes, Cp-Substituted Germylene, and a Germanium(II)-Borane Adduct from Pyridyl-1-azaallyl Germanium(II) Chloride","Organometallics","2012","31","19","6966","","10.1021/om3007739","","","0.71073","MoKα","","0.0575","0.0409","","","0.107","0.1227","","","","","","1.044","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079496","32.076","0.009","10.037","0.003","25.337","0.007","90","","105.284","0.004","90","","7869","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H47 B N7 O Y -","- C38 H47 B N7 O Y -","- C304 H376 B8 N56 O8 Y8 -","8","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.1228","0.0551","","","0.1102","0.124","","","","","","0.743","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079497","29.875","0.012","13.866","0.006","19.761","0.008","90","","130.51","0.004","90","","6224","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H64 B2 N16 Y2 -","- C54 H64 B2 N16 Y2 -","- C216 H256 B8 N64 Y8 -","4","0.5","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.0599","0.0378","","","0.0853","0.0895","","","","","","0.888","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079498","17.096","0.003","10.5725","0.0018","21.31","0.004","90","","96.693","0.002","90","","3825.5","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H44 B N8 Y -","- C41 H44 B N8 Y -","- C164 H176 B4 N32 Y4 -","4","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.0837","0.0466","","","0.1088","0.1279","","","","","","1.02","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079499","29.875","0.012","13.866","0.006","19.761","0.008","90","","130.51","0.004","90","","6224","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C H B N O Y -","- C2.84211 H3.36842 B0.105263 N0.842105 Y0.105263 -","- C216 H256 B8 N64 Y8 -","76","9.5","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.1065","0.0766","","","0.2428","0.2524","","","","","","2.19","","","","has coordinates","178683","2020-10-21","18:00:00",""
"4079500","11.085","0.004","18.454","0.007","43.113","0.017","90","","90","","90","","8819","6","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C40 H58 B N11 O P Y -","- C40 H58 B N11 O P Y -","- C320 H464 B8 N88 O8 P8 Y8 -","8","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.2106","0.1337","","","0.3208","0.3519","","","","","","0.995","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079501","9.358","0.003","19.903","0.007","20.811","0.007","101.252","0.006","102.343","0.006","102.955","0.006","3568","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H82 B2 N14 O2 Y2 -","- C62 H82 B2 N14 O2 Y2 -","- C124 H164 B4 N28 O4 Y4 -","2","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.2147","0.0827","","","0.2367","0.2758","","","","","","0.864","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079502","11.294","0.005","13.201","0.005","14.681","0.006","109.851","0.005","102.636","0.005","106.224","0.005","1853.7","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H40 B N8 Y -","- C34 H40 B N8 Y -","- C68 H80 B2 N16 Y2 -","2","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.0713","0.0464","","","0.1179","0.1233","","","","","","1","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079503","17.834","0.008","14.41","0.006","17.834","0.008","90","","90","","90","","4583","3","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C43 H59 B N12 O P Y -","- C35 H47 B N13 O P Y -","- C140 H188 B4 N52 O4 P4 Y4 -","4","1","","Yi, Weiyin; Zhang, Jie; Chen, Zhenxia; Zhou, Xigeng","Reactivity of Scorpionate-Anchored Yttrium Alkyl Complex toward Organic Nitriles","Organometallics","2012","31","20","7213","","10.1021/om3007773","","","0.71073","MoKα","","0.1131","0.085","","","0.2306","0.2477","","","","","","0.966","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079504","16.683","0.003","7.7392","0.0015","23.361","0.005","90","","106.68","0.03","90","","2889.3","1.1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H27 Cl2 N2 O3 S2 Y -","- C22 H27 Cl2 N2 O3 S2 Y -","- C88 H108 Cl8 N8 O12 S8 Y4 -","4","1","","Zhang, Wenjuan; Liu, Shaofeng; Yang, Wenhong; Hao, Xiang; Glaser, Rainer; Sun, Wen-Hua","Chloroyttrium 2-(1-(Arylimino)alkyl)quinolin-8-olate Complexes: Synthesis, Characterization, and Catalysis of the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2012","31","23","8178","","10.1021/om300778g","","","0.71073","MoKα","","0.0804","0.0689","","","0.1512","0.1577","","","","","","1.131","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079505","26.785","0.005","14.369","0.003","16.225","0.003","90","","121.89","0.03","90","","5302","2","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C23 H29 Cl2 N2 O3 S2 Y -","- C23 H29 Cl2 N2 O3 S2 Y -","- C184 H232 Cl16 N16 O24 S16 Y8 -","8","1","","Zhang, Wenjuan; Liu, Shaofeng; Yang, Wenhong; Hao, Xiang; Glaser, Rainer; Sun, Wen-Hua","Chloroyttrium 2-(1-(Arylimino)alkyl)quinolin-8-olate Complexes: Synthesis, Characterization, and Catalysis of the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2012","31","23","8178","","10.1021/om300778g","","","0.71073","MoKα","","0.0824","0.0707","","","0.1833","0.1902","","","","","","1.208","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079506","12.856","0.003","15.165","0.003","18.681","0.004","80.81","0.03","79.36","0.03","73.6","0.03","3411.4","1.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C54 H74 Cl4 N4 O6 S4 Y2 -","- C54 H74 Cl4 N4 O6 S4 Y2 -","- C108 H148 Cl8 N8 O12 S8 Y4 -","2","1","","Zhang, Wenjuan; Liu, Shaofeng; Yang, Wenhong; Hao, Xiang; Glaser, Rainer; Sun, Wen-Hua","Chloroyttrium 2-(1-(Arylimino)alkyl)quinolin-8-olate Complexes: Synthesis, Characterization, and Catalysis of the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2012","31","23","8178","","10.1021/om300778g","","","0.71073","MoKα","","0.1129","0.082","","","0.179","0.1947","","","","","","1.085","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079507","17.277","0.004","20.115","0.004","20.357","0.004","109.92","0.03","107.41","0.03","94.64","0.03","6213","3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H100 Cl8 N8 O6 Y4 -","- C92 H100 Cl8 N8 O6 Y4 -","- C184 H200 Cl16 N16 O12 Y8 -","2","1","","Zhang, Wenjuan; Liu, Shaofeng; Yang, Wenhong; Hao, Xiang; Glaser, Rainer; Sun, Wen-Hua","Chloroyttrium 2-(1-(Arylimino)alkyl)quinolin-8-olate Complexes: Synthesis, Characterization, and Catalysis of the Ring-Opening Polymerization of ε-Caprolactone","Organometallics","2012","31","23","8178","","10.1021/om300778g","","","0.71073","MoKα","","0.117","0.0778","","","0.1979","0.2218","","","","","","1.006","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079508","6.5754","0.0004","8.8183","0.0005","13.3673","0.0008","72.254","0.002","85.602","0.001","79.434","0.002","725.51","0.07","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H13 O5 P W -","- C13 H13 O5 P W -","- C26 H26 O10 P2 W2 -","2","1","","Ho, Feny; Li, Yongxin; Mathey, François","Role of Steric Strain in the Chemistry of Phosphiranes","Organometallics","2012","31","23","8456","","10.1021/om3007807","","","0.71073","MoKα","","0.0284","0.0261","","","0.0548","0.0555","","","","","","1.062","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079509","23.5818","0.0007","10.3225","0.0003","6.3947","0.0002","90","","90","","90","","1556.62","0.08","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C13 H13 O5 P W -","- C13 H13 O5 P W -","- C52 H52 O20 P4 W4 -","4","1","","Ho, Feny; Li, Yongxin; Mathey, François","Role of Steric Strain in the Chemistry of Phosphiranes","Organometallics","2012","31","23","8456","","10.1021/om3007807","","","0.71073","MoKα","","0.0491","0.0329","","","0.0603","0.0638","","","","","","1.147","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079510","12.7022","0.0003","15.6607","0.0003","23.8898","0.0005","90","","90","","90","","4752.29","0.18","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C53 H67 Cl2 N2 O P Ru -","- C53 H67 Cl2 N2 O P Ru -","- C212 H268 Cl8 N8 O4 P4 Ru4 -","4","1","","Ablialimov, Osman; Kędziorek, Mariusz; Torborg, Christian; Malińska, Maura; Woźniak, Krzysztof; Grela, Karol","New Ruthenium(II) Indenylidene Complexes Bearing Unsymmetrical N-Heterocyclic Carbenes","Organometallics","2012","31","21","7316","","10.1021/om300783g","","","0.71073","","","0.0625","0.0434","","","0.1219","0.1396","","","","","","1.221","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079511","7.9196","0.0003","14.5983","0.0005","25.844","0.0009","90","","90","","90","","2987.89","0.18","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 Cl2 N2 O3 Ru -","- C32 H38 Cl2 N2 O3 Ru -","- C128 H152 Cl8 N8 O12 Ru4 -","4","1","","Pump, Eva; Fischer, Roland C.; Slugovc, Christian","Halide Exchange in Second-Generationcis-Dihalo Ruthenium Benzylidene Complexes","Organometallics","2012","31","19","6972","","10.1021/om300785t","","","0.71073","MoKα","","0.039","0.028","","","0.0703","0.0742","","","","","","1.061","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079512","8.0758","0.0009","20.488","0.0019","21.52","0.002","108.225","0.003","97.87","0.004","96.013","0.004","3308.7","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C32.5 H39 Cl1.89 I1.11 N2 O3 Ru -","- C32.5 H39 Cl1.8881 I1.1119 N2 O3 Ru -","- C130 H156 Cl7.5524 I4.4476 N8 O12 Ru4 -","4","2","","Pump, Eva; Fischer, Roland C.; Slugovc, Christian","Halide Exchange in Second-Generationcis-Dihalo Ruthenium Benzylidene Complexes","Organometallics","2012","31","19","6972","","10.1021/om300785t","","","0.71073","MoKα","","0.072","0.0387","","","0.0805","0.0876","","","","","","1.03","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079513","8.3539","0.0003","21.1185","0.0007","21.0212","0.0008","107.501","0.001","98.358","0.002","95.731","0.001","3458.6","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C32.5 H39 Cl I2 N2 O3 Ru -","- C32.5 H39 Cl I2 N2 O3 Ru -","- C130 H156 Cl4 I8 N8 O12 Ru4 -","4","2","","Pump, Eva; Fischer, Roland C.; Slugovc, Christian","Halide Exchange in Second-Generationcis-Dihalo Ruthenium Benzylidene Complexes","Organometallics","2012","31","19","6972","","10.1021/om300785t","","","0.71073","MoKα","","0.0541","0.0456","","","0.1326","0.14","","","","","","1.067","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079514","8.0634","0.0017","11.8821","0.0013","11.986","0.003","75.381","0.011","71.954","0.016","85.489","0.013","1056.5","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H52 Cl10 Ru3 -","- C32 H52 Cl10 Ru3 -","- C32 H52 Cl10 Ru3 -","1","0.5","","Tskhovrebov, Alexander G.; Solari, Euro; Scopelliti, Rosario; Severin, Kay","Activation of Nitrous Oxide by Dinuclear Ruthenium Complexes","Organometallics","2012","31","20","7235","","10.1021/om300786f","","","0.71073","MoKα","","0.0992","0.0609","","","0.1368","0.1593","","","","","","1.038","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079515","27.618","0.004","14.453","0.003","18.611","0.003","90","","110.138","0.01","90","","6975","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31.5 H39 Cl5 N4 Ru2 -","- C31.5 H39 Cl5 N4 Ru2 -","- C252 H312 Cl40 N32 Ru16 -","8","1","","Tskhovrebov, Alexander G.; Solari, Euro; Scopelliti, Rosario; Severin, Kay","Activation of Nitrous Oxide by Dinuclear Ruthenium Complexes","Organometallics","2012","31","20","7235","","10.1021/om300786f","","","0.71073","MoKα","","0.0294","0.0217","","","0.0466","0.0509","","","","","","1.096","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079516","17.138","0.005","12.6913","0.0017","16.175","0.004","90","","100.96","0.02","90","","3453.9","1.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H39 Cl6 N2 O Ru2 -","- C32 H39 Cl6 N2 O Ru2 -","- C128 H156 Cl24 N8 O4 Ru8 -","4","1","","Tskhovrebov, Alexander G.; Solari, Euro; Scopelliti, Rosario; Severin, Kay","Activation of Nitrous Oxide by Dinuclear Ruthenium Complexes","Organometallics","2012","31","20","7235","","10.1021/om300786f","","","0.71073","MoKα","","0.1283","0.0729","","","0.1081","0.1226","","","","","","1.194","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079517","7.2298","0.0015","12.45","0.002","27.612","0.004","97.52","0.02","96.02","0.02","104.13","0.02","2365.1","0.8","100","2","100","2","","","","","","","acetonitrile, diethylether, hexane","7","P -1","-P 1","2","","","","- C53 H43 Cl3 Fe2 N6 O6 Ru -","- C53 H43 Cl3 Fe2 N6 O6 Ru -","- C106 H86 Cl6 Fe4 N12 O12 Ru2 -","2","1","","Sathyaraj, Gopal; Kiruthika, Mathiyalagan; Weyhermüller, Thomas; Unni Nair, Balachandran","Oxidative Cleavage of DNA by Ruthenium(II) Complexes Containing a Ferrocene/Non-Ferrocene Conjugated Imidazole Phenol Ligand","Organometallics","2012","31","19","6980","","10.1021/om3007882","","","0.71073","MoKα","","0.0528","0.0343","","","0.0705","0.0781","","","","","","1.035","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079518","29.511","0.0016","13.3179","0.0007","32.1453","0.0017","90","","109.255","0.003","90","","11927.2","1.1","170","2","170","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C55 H37 B Cl F27 Ir N5 O -","- C55 H37 B Cl F27 Ir N5 O -","- C440 H296 B8 Cl8 F216 Ir8 N40 O8 -","8","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0804","0.0509","","","0.1341","0.1536","","","","","","1.011","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079519","19.409","0.0008","17.2163","0.0008","21.637","0.001","90","","112.133","0.002","90","","6697.3","0.5","170","2","170","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H40 B Cl3 F27 Ir N5 -","- C58 H40 B Cl3.01 F27 Ir N5 -","- C232 H160 B4 Cl12.04 F108 Ir4 N20 -","4","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0618","0.0514","","","0.1575","0.1664","","","","","","1.152","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079520","39.396","0.004","18.3734","0.0016","16.48","0.0016","90","","106.912","0.005","90","","11413","1.9","160","2","160","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48.75 H26 B Cl1.5 F24 N6 O4 Rh -","- C48.75 H26 B Cl1.52 F24.1 N6 O4 Rh -","- C390 H208 B8 Cl12.16 F192.8 N48 O32 Rh8 -","8","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0645","0.0557","","","0.1646","0.183","","","","","","0.755","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079521","12.5013","0.0014","16.375","0.0008","16.937","0.0008","117.541","0.002","96.775","0.002","101.575","0.002","2921.8","0.4","151","2","151","2","","","","","","","","7","P -1","-P 1","2","","","","- C55.5 H41 B Cl2 F24 Ir N5 -","- C55.5 H41 B Cl2 F23.97 Ir N5 -","- C111 H82 B2 Cl4 F47.94 Ir2 N10 -","2","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0195","0.0186","","","0.0467","0.0474","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079522","12.0829","0.0005","24.4058","0.001","13.3522","0.0005","90","","93.701","0.002","90","","3929.3","0.3","156","2","156","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H46 B Cl Ir N5 -","- C46 H46 B Cl Ir N5 -","- C184 H184 B4 Cl4 Ir4 N20 -","4","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0182","0.0167","","","0.0408","0.0416","","","","","","1.066","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079523","28.8655","0.0012","12.9022","0.0005","29.8343","0.0012","90","","104.722","0.001","90","","10746.4","0.7","155","2","155","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49.38 H35 B Cl1.75 F24 Ir N4 -","- C49.38 H35 B Cl1.75 F23.97 Ir N4 -","- C395.04 H280 B8 Cl14 F191.76 Ir8 N32 -","8","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0374","0.031","","","0.1203","0.1323","","","","","","1.182","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079524","12.4931","0.0016","16.3598","0.0008","16.8978","0.001","117.365","0.002","96.805","0.003","101.47","0.003","2917.2","0.4","152","2","152","2","","","","","","","","7","P -1","-P 1","2","","","","- C55.5 H41 B Cl2 F24 N5 Rh -","- C55.5 H41 B Cl2 F23.97 N5 Rh -","- C111 H82 B2 Cl4 F47.94 N10 Rh2 -","2","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.0441","0.0346","","","0.0783","0.0822","","","","","","1.042","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079525","29.9749","0.0017","13.0963","0.0008","36.371","0.002","90","","111.572","0.002","90","","13277.7","1.3","151","2","151","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54.88 H39.75 B Cl2.75 F24 N5 Rh -","- C54.88 H39.76 B Cl2.8 F24 N5 Rh -","- C439.04 H318.08 B8 Cl22.4 F192 N40 Rh8 -","8","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.1136","0.0883","","","0.2429","0.2599","","","","","","1.102","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079526","12.0994","0.0003","24.4422","0.0007","13.3308","0.0004","90","","93.565","0.001","90","","3934.77","0.19","155","2","155","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H46 B Cl N5 Rh -","- C46 H46 B Cl N5 Rh -","- C184 H184 B4 Cl4 N20 Rh4 -","4","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.1904","0.0269","","","0.0634","0.0683","","","","","","1.061","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079527","28.8126","0.001","12.8881","0.0004","29.9049","0.0011","90","","104.623","0.002","90","","10745.2","0.6","152","2","152","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49.12 H35 B Cl1.25 F24 N4 Rh -","- C49.13 H35 B Cl1.26 F24 N4 Rh -","- C393.04 H280 B8 Cl10.08 F192 N32 Rh8 -","8","1","","Wong, Chin Min; Vuong, Khuong Q.; Gatus, Mark R. D.; Hua, Carol; Bhadbhade, Mohan; Messerle, Barbara A.","Catalyzed Tandem C‒N/C‒C Bond Formation for the Synthesis of Tricyclic Indoles using Ir(III) Pyrazolyl-1,2,3-Triazolyl Complexes","Organometallics","2012","31","21","7500","","10.1021/om300792b","","","0.71073","MoKα","","0.1026","0.0748","","","0.2038","0.2218","","","","","","1.461","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079528","16.5802","0.00004","18.09136","0.00004","19.48429","0.00004","90","","90","","90","","5844.48","0.02","115","","115","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H54 N P3 Ru -","- C25 H54 N P3 Ru -","- C200 H432 N8 P24 Ru8 -","8","1","","Scherl, Peter; Kruckenberg, Achim; Mader, Steffen; Wadepohl, Hubert; Gade, Lutz H.","Ruthenium η4-Trimethylenemethane Complexes Containing Tripodal Phosphanomethylamine Ligands","Organometallics","2012","31","19","7024","","10.1021/om300794h","","x-ray","1.5418","CuKα","","0.0174","0.0172","","","0.0434","0.0436","","","","","","1.053","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079529","10.2667","0.00003","13.3407","0.00005","22.72424","0.00006","90","","90","","90","","3112.43","0.017","114.99","0.1","114.99","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H56 N P3 Ru -","- C29 H56 N P3 Ru -","- C116 H224 N4 P12 Ru4 -","4","1","","Scherl, Peter; Kruckenberg, Achim; Mader, Steffen; Wadepohl, Hubert; Gade, Lutz H.","Ruthenium η4-Trimethylenemethane Complexes Containing Tripodal Phosphanomethylamine Ligands","Organometallics","2012","31","19","7024","","10.1021/om300794h","","x-ray","1.5418","CuKα","","0.0132","0.0132","","","0.0338","0.0338","","","","","","1.063","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079530","8.48059","0.00006","9.12047","0.00006","34.1042","0.0003","90","","90","","90","","2637.86","0.03","114.97","0.11","114.97","0.11","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H48 N P3 Ru -","- C25 H48 N P3 Ru -","- C100 H192 N4 P12 Ru4 -","4","1","","Scherl, Peter; Kruckenberg, Achim; Mader, Steffen; Wadepohl, Hubert; Gade, Lutz H.","Ruthenium η4-Trimethylenemethane Complexes Containing Tripodal Phosphanomethylamine Ligands","Organometallics","2012","31","19","7024","","10.1021/om300794h","","x-ray","1.5418","CuKα","","0.0197","0.0193","","","0.0484","0.0485","","","","","","1.097","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079531","10.765","0.0001","11.5015","0.0002","12.5253","0.0002","88.76","0.001","65.414","0.002","84.114","0.001","1402.39","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 N4 O10 W2 -","- C24 H18 N4 O10 W2 -","- C48 H36 N8 O20 W4 -","2","1","","Kuo, Hsin-Ya; Liu, Yi-Hong; Peng, Shie-Ming; Liu, Shiuh-Tzung","N,N′-Dialkylation Catalyzed by Bimetallic Iridium Complexes Containing a Saturated Bis-N-Heterocyclic Carbene (NHC) Ligand","Organometallics","2012","31","20","7248","","10.1021/om300800c","","","0.71073","MoKα","","0.0279","0.0225","","","0.0528","0.0561","","","","","","1.013","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079532","13.6471","0.0002","25.3253","0.0003","17.3337","0.0002","90","","99.907","0.001","90","","5901.49","0.13","150","2","150","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C108 H96 Cl18 F12 Ir2 N4 O2 P6 -","- C108 H96 Cl18 F12 Ir2 N4 O2 P6 -","- C216 H192 Cl36 F24 Ir4 N8 O4 P12 -","2","0.5","","Kuo, Hsin-Ya; Liu, Yi-Hong; Peng, Shie-Ming; Liu, Shiuh-Tzung","N,N′-Dialkylation Catalyzed by Bimetallic Iridium Complexes Containing a Saturated Bis-N-Heterocyclic Carbene (NHC) Ligand","Organometallics","2012","31","20","7248","","10.1021/om300800c","","","0.71073","MoKα","","0.0995","0.0573","","","0.1342","0.1501","","","","","","0.963","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079533","9.9732","0.0002","10.3045","0.0002","13.5611","0.0003","77.476","0.0013","69.497","0.0012","66.643","0.0012","1193.46","0.04","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H22 Cl F N P Pt -","- C29 H22 Cl F N P Pt -","- C58 H44 Cl2 F2 N2 P2 Pt2 -","2","1","","Crosby, Sarah H.; Clarkson, Guy J.; Rourke, Jonathan P.","Relieving Steric Strain at Octahedral Platinum(IV): Isomerization and Reductive Coupling of Alkyl and Aryl Chlorides","Organometallics","2012","31","20","7256","","10.1021/om3008019","","","0.71073","MoKα","","0.0218","0.0199","","","0.0427","0.0434","","","","","","1.061","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079534","10.3283","0.0001","11.1027","0.0002","17.3489","0.0003","96.728","0.001","102.118","0.001","115.877","0.001","1700.07","0.05","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H24 Cl9 F N P Pt -","- C31 H24 Cl9 F N P Pt -","- C62 H48 Cl18 F2 N2 P2 Pt2 -","2","1","","Crosby, Sarah H.; Clarkson, Guy J.; Rourke, Jonathan P.","Relieving Steric Strain at Octahedral Platinum(IV): Isomerization and Reductive Coupling of Alkyl and Aryl Chlorides","Organometallics","2012","31","20","7256","","10.1021/om3008019","","","0.71073","MoKα","","0.0281","0.0249","","","0.0548","0.0561","","","","","","1.035","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079535","29.2355","0.0018","29.2355","0.0018","12.9427","0.0016","90","","90","","90","","11062.3","1.7","153","2","153","2","","","","","","","","7","I -4","I -4","82","","","","- C152 H304 Ga8 N8 O24 S4 Si16 -","- C152 H304 Ga8 N8 O24 S4 Si16 -","- C304 H608 Ga16 N16 O48 S8 Si32 -","2","0.25","","Uhl, Werner; Stefaniak, Christina; Voß, Matthias; Kösters, Jutta; Rogel, Friedhelm","Gallium‒Gallium Bonds As Effective Templates for the Generation of Macrocycles and Supramolecular Entities","Organometallics","2012","31","19","6988","","10.1021/om3008025","","","0.71073","MoKα","","0.0565","0.0426","","","0.1172","0.1243","","","","","","1.034","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079536","19.9807","0.0012","20.8609","0.0012","23.5307","0.0014","99.833","0.001","95.001","0.001","100.037","0.001","9446.6","1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C92 H176 Ga8 N8 O9 Si16 -","- C92 H176 Ga8 N8 O9 Si16 -","- C184 H352 Ga16 N16 O18 Si32 -","2","1","","Uhl, Werner; Stefaniak, Christina; Voß, Matthias; Kösters, Jutta; Rogel, Friedhelm","Gallium‒Gallium Bonds As Effective Templates for the Generation of Macrocycles and Supramolecular Entities","Organometallics","2012","31","19","6988","","10.1021/om3008025","","","0.71073","MoKα","","0.0713","0.041","","","0.0883","0.0943","","","","","","0.832","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079537","19.3512","0.0012","22.3179","0.0014","25.9585","0.0017","105.232","0.001","110.396","0.001","104.066","0.001","9419.4","1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H176 Ga8 N8 O9 Si16 -","- C84 H176 Ga8 N8 O9 Si16 -","- C168 H352 Ga16 N16 O18 Si32 -","2","1","","Uhl, Werner; Stefaniak, Christina; Voß, Matthias; Kösters, Jutta; Rogel, Friedhelm","Gallium‒Gallium Bonds As Effective Templates for the Generation of Macrocycles and Supramolecular Entities","Organometallics","2012","31","19","6988","","10.1021/om3008025","","","0.71073","MoKα","","0.0737","0.041","","","0.0999","0.1069","","","","","","0.9","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079538","10.737","0.0008","13.1719","0.0009","14.168","0.001","90","","102.222","0.002","90","","1958.3","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C42 H48 Cl Co N4 -","- C42 H48 Cl Co N4 -","- C84 H96 Cl2 Co2 N8 -","2","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.113","0.0498","","","0.0961","0.1249","","","","","","1.074","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079539","29.405","0.004","11.8895","0.0014","32.603","0.004","90","","101.185","0.002","90","","11182","2","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H68 B Co N4 -","- C66 H68 B Co N4 -","- C528 H544 B8 Co8 N32 -","8","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.0719","0.0464","","","0.1138","0.1275","","","","","","1.008","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079540","10.9031","0.0007","12.8177","0.0008","14.6435","0.0009","75.971","0.001","74.347","0.001","80.87","0.001","1902.2","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C42 H47 Co N6 -","- C42 H47 Co N6 -","- C84 H94 Co2 N12 -","2","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.0589","0.044","","","0.105","0.1105","","","","","","0.966","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079541","8.5981","0.0003","26.6843","0.0011","15.936","0.0006","90","","101.174","0.001","90","","3587","0.2","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 Co N4 -","- C42 H46 Co N4 -","- C168 H184 Co4 N16 -","4","0.5","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.0441","0.0341","","","0.0877","0.0939","","","","","","1.07","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079542","15.372","0.005","10.579","0.003","24.828","0.008","90","","94.324","0.005","90","","4026","2","133","2","133","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H45 Co N4 O3 -","- C45 H45 Co N4 O3 -","- C180 H180 Co4 N16 O12 -","4","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.1118","0.0609","","","0.1465","0.1752","","","","","","1.005","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079543","10.8327","0.0018","15.455","0.003","15.49","0.003","115.717","0.002","90.852","0.003","100.984","0.003","2279.7","0.7","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H62 Co N5 -","- C54 H55 Co N5 -","- C108 H110 Co2 N10 -","2","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.0877","0.0671","","","0.1801","0.2063","","","","","","0.943","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079544","8.185","0.004","13.313","0.007","22.665","0.01","77.512","0.01","82.135","0.007","72.777","0.007","2296.1","1.9","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H56 Co N6 O2 -","- C52 H56 Co N6 O2 -","- C104 H112 Co2 N12 O4 -","2","1","","Mo, Zhenbo; Chen, Dake; Leng, Xuebin; Deng, Liang","Intramolecular C(sp3)‒H Bond Activation Reactions of Low-Valent Cobalt Complexes with Coordination Unsaturation","Organometallics","2012","31","20","7040","","10.1021/om300804a","","","0.71073","MoKα","","0.1215","0.0772","","","0.2043","0.26","","","","","","1.049","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079545","8.2872","0.0002","15.8767","0.0004","18.6988","0.0005","90","","90","","90","","2460.26","0.11","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 Cl3 I2 N4 O Pt -","- C17 H23 Cl3 I2 N4 O Pt -","- C68 H92 Cl12 I8 N16 O4 Pt4 -","4","1","","Chardon, Edith; Dahm, Georges; Guichard, Gilles; Bellemin-Laponnaz, Stéphane","Derivatization of Preformed Platinum N-Heterocyclic Carbene Complexes with Amino Acid and Peptide Ligands and Cytotoxic Activities toward Human Cancer Cells","Organometallics","2012","31","21","7618","","10.1021/om300806g","","","0.71073","MoKα","","0.0409","0.0337","","","0.0856","0.1073","","","","","","1.174","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079546","9.5879","0.0019","18.125","0.004","21.11","0.004","70.52","0.03","82","0.03","87.25","0.03","3424.9","1.4","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C28 H36 I2 N5 O4 Pt -","- C28 H36 I2 N5 O4 Pt -","- C112 H144 I8 N20 O16 Pt4 -","4","4","","Chardon, Edith; Dahm, Georges; Guichard, Gilles; Bellemin-Laponnaz, Stéphane","Derivatization of Preformed Platinum N-Heterocyclic Carbene Complexes with Amino Acid and Peptide Ligands and Cytotoxic Activities toward Human Cancer Cells","Organometallics","2012","31","21","7618","","10.1021/om300806g","","","1.54178","CuKα","","0.0715","0.0512","","","0.1113","0.1404","","","","","","0.901","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079547","10.041","0.002","11.149","0.002","15.588","0.003","98.09","0.03","96.21","0.03","112.27","0.03","1573.8","0.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H32 Cl2 F6 N4 P Rh -","- C31 H32 Cl2 F6 N4 P Rh -","- C62 H64 Cl4 F12 N8 P2 Rh2 -","2","1","","Gierz, Verena; Urbanaite, Aurelija; Seyboldt, Alexander; Kunz, Doris","Rhodium Complexes Bearing 1,10-Phenanthroline Analogue Bis-NHC Ligands Are Active Catalysts for Transfer Hydrogenation of Ketones","Organometallics","2012","31","21","7532","","10.1021/om3008103","","","0.71073","MoKα","","0.0472","0.0357","","","0.0743","0.0777","","","","","","1.026","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079548","7.1041","0.0013","9.667","0.0018","13.246","0.003","94.045","0.002","104.492","0.002","102.838","0.002","851","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H9 Br N6 O8 -","- C15 H9 Br N6 O8 -","- C30 H18 Br2 N12 O16 -","2","1","","Sato, Tetsuo; Hirose, Yoichi; Yoshioka, Daisuke; Oi, Shuichi","N-Heterocyclic Carbenes with aN-2,4-Dinitrophenyl Substituent: Comparison with PPh3and IPr","Organometallics","2012","31","19","6995","","10.1021/om300814f","","","0.71073","MoKα","","0.0244","0.0233","","","0.0586","0.0593","","","","","","1.023","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079549","8.045","0.003","8.458","0.003","11.588","0.004","75.883","0.003","81.523","0.004","87.523","0.004","756.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H9 F3 N4 O7 S -","- C11 H9 F3 N4 O7 S -","- C22 H18 F6 N8 O14 S2 -","2","1","","Sato, Tetsuo; Hirose, Yoichi; Yoshioka, Daisuke; Oi, Shuichi","N-Heterocyclic Carbenes with aN-2,4-Dinitrophenyl Substituent: Comparison with PPh3and IPr","Organometallics","2012","31","19","6995","","10.1021/om300814f","","","0.71073","MoKα","","0.0413","0.0331","","","0.0808","0.0859","","","","","","1.059","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079550","17.649","0.003","7.1994","0.001","19.254","0.003","90","","97.42","0.002","90","","2426","0.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H20 Cl N6 O8 Rh -","- C23 H20 Cl N6 O8 Rh -","- C92 H80 Cl4 N24 O32 Rh4 -","4","1","","Sato, Tetsuo; Hirose, Yoichi; Yoshioka, Daisuke; Oi, Shuichi","N-Heterocyclic Carbenes with aN-2,4-Dinitrophenyl Substituent: Comparison with PPh3and IPr","Organometallics","2012","31","19","6995","","10.1021/om300814f","","","0.71073","MoKα","","0.0266","0.0233","","","0.0616","0.0638","","","","","","1.042","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079551","11.1268","0.0016","12.8969","0.0018","13.3256","0.0019","90","","93.124","0.002","90","","1909.4","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl N4 O4 Rh -","- C18 H20 Cl N4 O4 Rh -","- C72 H80 Cl4 N16 O16 Rh4 -","4","1","","Sato, Tetsuo; Hirose, Yoichi; Yoshioka, Daisuke; Oi, Shuichi","N-Heterocyclic Carbenes with aN-2,4-Dinitrophenyl Substituent: Comparison with PPh3and IPr","Organometallics","2012","31","19","6995","","10.1021/om300814f","","","0.71073","MoKα","","0.0261","0.0236","","","0.0633","0.0658","","","","","","1.075","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079552","14.772","0.002","9.0891","0.0015","17.99","0.003","90","","113.251","0.002","90","","2219.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Au Cl N6 O9 -","- C18 H14 Au Cl N6 O9 -","- C72 H56 Au4 Cl4 N24 O36 -","4","1","","Sato, Tetsuo; Hirose, Yoichi; Yoshioka, Daisuke; Oi, Shuichi","N-Heterocyclic Carbenes with aN-2,4-Dinitrophenyl Substituent: Comparison with PPh3and IPr","Organometallics","2012","31","19","6995","","10.1021/om300814f","","","0.71073","MoKα","","0.0309","0.0259","","","0.0587","0.0606","","","","","","1.083","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079553","9.68","0.003","16.35","0.005","17.323","0.006","62.204","0.007","78.902","0.008","86.599","0.008","2378.5","1.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","T-Pt-Ac","","","- C51 H66 P2 Pt Si -","- C51 H66 P2 Pt Si -","- C102 H132 P4 Pt2 Si2 -","2","1","","Nguyen, Minh-Hai; Yip, John H. K.","Platinum-Conjugated Homo- and Heterobichromophoric Complexes of Tetracene and Pentacene","Organometallics","2012","31","21","7522","","10.1021/om300815b","","","0.71073","MoKα","","0.1231","0.0787","","","0.1504","0.1664","","","","","","1.032","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079554","30.112","0.002","25.0907","0.0017","24.4373","0.0019","90","","91.597","0.003","90","","18456","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","P-Pt-I","","","- C47 H62.5 I P2 Pt Si -","- C47 H62.5 I P2 Pt Si -","- C752 H1000 I16 P32 Pt16 Si16 -","16","4","","Nguyen, Minh-Hai; Yip, John H. K.","Platinum-Conjugated Homo- and Heterobichromophoric Complexes of Tetracene and Pentacene","Organometallics","2012","31","21","7522","","10.1021/om300815b","","","0.71073","MoKα","","0.0848","0.0542","","","0.1258","0.1407","","","","","","0.941","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079555","38.177","0.005","11.018","0.0014","17.077","0.002","90","","103.17","0.003","90","","6994.2","1.5","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","T-Pt-T","","","- C75 H94 Cl2 P2 Pt Si2 -","- C75 H94 Cl2 P2 Pt Si2 -","- C300 H376 Cl8 P8 Pt4 Si8 -","4","0.5","","Nguyen, Minh-Hai; Yip, John H. K.","Platinum-Conjugated Homo- and Heterobichromophoric Complexes of Tetracene and Pentacene","Organometallics","2012","31","21","7522","","10.1021/om300815b","","","0.71073","MoKα","","0.059","0.0469","","","0.0994","0.1042","","","","","","1.041","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079556","7.2711","0.0013","11.622","0.002","21.039","0.004","86.29","0.004","81.186","0.004","81.257","0.004","1734.9","0.5","273","2","273","2","","","","","","","","5","P -1","-P 1","2","P-Pt-P","","","- C82 H96 P2 Pt Si2 -","- C82 H96 P2 Pt Si2 -","- C82 H96 P2 Pt Si2 -","1","0.5","","Nguyen, Minh-Hai; Yip, John H. K.","Platinum-Conjugated Homo- and Heterobichromophoric Complexes of Tetracene and Pentacene","Organometallics","2012","31","21","7522","","10.1021/om300815b","","","0.71073","MoKα","","0.0705","0.0607","","","0.1288","0.139","","","","","","1.076","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079557","10.2238","0.001","9.6635","0.0009","11.2356","0.0011","90","","101.295","0.001","90","","1088.55","0.18","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C28 H28 Zr -","- C28 H28 Zr -","- C56 H56 Zr2 -","2","1","","Rong, Yi; Al-Harbi, Ahmed; Parkin, Gerard","Highly Variable Zr‒CH2‒Ph Bond Angles in Tetrabenzylzirconium: Analysis of Benzyl Ligand Coordination Modes","Organometallics","2012","31","23","8208","","10.1021/om300820b","","","0.71073","MoKα","","0.056","0.0377","","","0.0646","0.0705","","","","","","1.006","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079558","9.587","0.003","27.381","0.007","9.049","0.002","90","","108.11","0.004","90","","2257.7","1","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H29 O P Ti -","- C26 H29 O P Ti -","- C104 H116 O4 P4 Ti4 -","4","1","","Li, Ling; Kristian, Kathleen E.; Han, Arthur; Norton, Jack R.; Sattler, Wesley","Synthesis, Structural Characterization, and Reactivity of Cp2- and (CpMe)2-Ligated Titanaaziridines and Titanaoxiranes with Fast Enantiomer Interconversion Rates","Organometallics","2012","31","23","8218","","10.1021/om300825n","","","0.71073","MoKα","","0.1134","0.0613","","","0.1175","0.1329","","","","","","1.236","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079559","8.4169","0.0015","25.405","0.005","10.081","0.0018","90","","99.494","0.003","90","","2126.1","0.7","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 N P Ti -","- C26 H30 N P Ti -","- C104 H120 N4 P4 Ti4 -","4","1","","Li, Ling; Kristian, Kathleen E.; Han, Arthur; Norton, Jack R.; Sattler, Wesley","Synthesis, Structural Characterization, and Reactivity of Cp2- and (CpMe)2-Ligated Titanaaziridines and Titanaoxiranes with Fast Enantiomer Interconversion Rates","Organometallics","2012","31","23","8218","","10.1021/om300825n","","","0.71073","MoKα","","0.1019","0.052","","","0.1077","0.1256","","","","","","1.019","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079560","10.8928","0.0011","17","0.0016","13.9797","0.0015","90","","112.195","0.003","90","","2396.9","0.4","153","","153","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H17 Fe2 N O6 S -","- C26 H17 Fe2 N O6 S -","- C104 H68 Fe8 N4 O24 S4 -","4","1","","Hirotsu, Masakazu; Santo, Kiyokazu; Hashimoto, Hideki; Kinoshita, Isamu","Carbon- and Sulfur-Bridged Diiron Carbonyl Complexes Containing N,C,S-Tridentate Ligands Derived from Functionalized Dibenzothiophenes: Mimics of the [FeFe]-Hydrogenase Active Site","Organometallics","2012","31","21","7548","","10.1021/om300826y","","","0.7107","MoKα","","0.0752","0.05","","","0.0869","0.0945","","","","","","1.105","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079561","39.0863","0.0006","39.0863","0.0006","8.5612","0.0001","90","","90","","120","","11327","0.3","133","","133","","","","","","","","","6","R 3 :H","R 3","146","","","","- C26 H17 Fe2 N O5 S -","- C26 H17 Fe2 N O5 S -","- C468 H306 Fe36 N18 O90 S18 -","18","2","","Hirotsu, Masakazu; Santo, Kiyokazu; Hashimoto, Hideki; Kinoshita, Isamu","Carbon- and Sulfur-Bridged Diiron Carbonyl Complexes Containing N,C,S-Tridentate Ligands Derived from Functionalized Dibenzothiophenes: Mimics of the [FeFe]-Hydrogenase Active Site","Organometallics","2012","31","21","7548","","10.1021/om300826y","","","0.7107","MoKα","","0.0429","0.0414","","","0.1434","0.1452","","","","","","1.142","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079562","19.7883","0.0008","12.332","0.0004","7.1152","0.0013","90","","99.058","0.003","90","","1714.7","0.3","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Cl N4 O Rh -","- C16 H22 Cl N4 O Rh -","- C64 H88 Cl4 N16 O4 Rh4 -","4","1","","Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian","Converting Caffeine to Electronically Different N-Heterocyclic Carbenes with a Hypoxanthine Backbone","Organometallics","2012","31","20","7272","","10.1021/om300836w","","","0.71073","MoKα","","0.0375","0.0327","","","0.0834","0.0854","","","","","","1.098","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079563","11.616","0.002","9.597","0.0019","11.503","0.002","90","","99.45","0.03","90","","1264.9","0.4","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 B2 F8 N8 O2 -","- C18 H26 B2 F8 N8 O2 -","- C36 H52 B4 F16 N16 O4 -","2","0.5","","Makhloufi, Abdelaziz; Frank, Walter; Ganter, Christian","Converting Caffeine to Electronically Different N-Heterocyclic Carbenes with a Hypoxanthine Backbone","Organometallics","2012","31","20","7272","","10.1021/om300836w","","","0.71073","MoKα","","0.089","0.0722","","","0.1353","0.1414","","","","","","1.158","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079564","16.0057","0.0015","7.38","0.0006","14.2247","0.0013","90","","95.556","0.002","90","","1672.4","0.3","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 Ag4 Cl F0 N4 O10 -","- C7 H6 Ag4 Cl N4 O10 -","- C28 H24 Ag16 Cl4 N16 O40 -","4","1","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.0644","0.0577","","","0.1531","0.1625","","","","","","1.003","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079565","14.6177","0.0008","18.9092","0.001","19.2789","0.001","62.212","0.001","87.756","0.001","76.251","0.001","4563.3","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H30 Ag13 Cl7 F27 N7 O19 -","- C61 H29 Ag13 Cl7 F27 N7 O19 -","- C122 H58 Ag26 Cl14 F54 N14 O38 -","2","1","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.1029","0.0736","","","0.183","0.2076","","","","","","1.02","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079566","14.6146","0.0008","19.0197","0.0011","19.3313","0.0011","62.543","0.001","87.711","0.001","76.841","0.001","4629.8","0.5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H30 Ag13 Br7 F27 N7 O19 -","- C61 H29 Ag13 Br7 F27 N7 O19 -","- C122 H58 Ag26 Br14 F54 N14 O38 -","2","1","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.0923","0.0694","","","0.1819","0.2039","","","","","","1.002","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079567","7.7662","0.0008","13.7809","0.0013","18.9613","0.0018","109.657","0.002","92.874","0.002","98.726","0.002","1877.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H29 Ag14 F30 N6 O26 -","- C43 H29 Ag14 F30 N6 O26 -","- C43 H29 Ag14 F30 N6 O26 -","1","0.5","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.0856","0.0678","","","0.1837","0.2083","","","","","","0.959","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079568","12.1322","0.0006","16.2592","0.0008","18.0363","0.0009","80.571","0.001","82.94","0.001","75.276","0.001","3382.2","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H24 Ag8 F18 N12 O12 -","- C52 H24 Ag8 F18 N12 O12 -","- C104 H48 Ag16 F36 N24 O24 -","2","1","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.0853","0.0726","","","0.1824","0.1929","","","","","","1.038","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079569","14.9245","0.0019","16.1583","0.0018","25.451","0.003","98.792","0.002","99.649","0.003","97.927","0.002","5894.9","1.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H32 Ag12 F30 N16 O20 -","- C44 H28 Ag12 F30 N20 O20 -","- C132 H84 Ag36 F90 N60 O60 -","3","1.5","","Hu, Ting; Zhao, Liang; Mak, Thomas C. W.","Assembly of Silver-Organic Frameworks and Discrete Molecules Containing Embedded 1,3-Butadiyne-1,4-diide with Ancillary Heteroaromatic N-Donor Ligands","Organometallics","2012","31","21","7539","","10.1021/om300838r","","","0.71073","MoKα","","0.1127","0.0698","","","0.1751","0.2034","","","","","","1.004","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079570","10.9124","0.0013","11.399","0.0012","14.8482","0.0018","83.332","0.005","78.022","0.005","63.468","0.004","1615.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H43 Cr N2 O3 S -","- C36 H43 Cr N2 O3 S -","- C72 H86 Cr2 N4 O6 S2 -","2","1","","Zhou, Wen; MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Controlling Secondary Alkyl Radicals: Ligand Effects in Chromium-Catalyzed C‒P Bond Formation","Organometallics","2012","31","21","7324","","10.1021/om300846u","","","0.71073","MoKα","","0.059","0.0398","","","0.0937","0.1031","","","","","","1.05","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079571","14.8508","0.0014","10.1551","0.001","20.959","0.002","90","","99.007","0.005","90","","3121.9","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C35 H47 Cr N2 -","- C35 H47 Cr N2 -","- C140 H188 Cr4 N8 -","4","1","","Zhou, Wen; MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Controlling Secondary Alkyl Radicals: Ligand Effects in Chromium-Catalyzed C‒P Bond Formation","Organometallics","2012","31","21","7324","","10.1021/om300846u","","","0.71073","MoKα","","0.0731","0.0544","","","0.1365","0.1507","","","","","","1.081","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079572","12.4705","0.0004","24.0249","0.0011","17.0948","0.0008","90","","107.785","0.002","90","","4876.9","0.4","223","","","","","","","","","","Chen laboratory","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H55 Cl7 N2 Nb O3 -","- C42 H55 Cl7 N2 Nb O3 -","- C168 H220 Cl28 N8 Nb4 O12 -","4","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.1121","0.0831","","","0.2192","0.2397","","","","","","1.502","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079573","13.2231","0.0002","17.5266","0.0003","17.9374","0.0003","81.6621","0.0007","84.7026","0.0007","71.3669","0.0008","3892.87","0.11","223","","","","","","","","","","Chen laboratory","7","P -1","-P 1","2","","","","- C68 H58 B F24 N2 Nb O3 -","- C80 H70 B F24 N2 Nb O3 -","- C160 H140 B2 F48 N4 Nb2 O6 -","2","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.0833","0.0639","","","0.1734","0.1871","","","","","","1.237","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079574","14.2665","0.0003","29.5664","0.0007","20.3114","0.0004","90","","91.759","0.002","90","","8563.5","0.3","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H104 N8 Nb2 O14 Re2 -","- C80 H104 N8 Nb2 O14 Re2 -","- C320 H416 N32 Nb8 O56 Re8 -","4","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.7107","MoKα","","0.1259","0.0789","","","0.168","0.1973","","","","","","1.083","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079575","14.4884","0.0005","14.4884","0.0005","14.8018","0.0008","90","","90","","120","","2690.8","0.2","223","","","","","","","","","","LOC ETH Zurich","5","P 31","P 31","144","","","","- C32 H27 B F18 O3 -","- C32 H25 B F18 O3 -","- C96 H75 B3 F54 O9 -","3","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.1229","0.0909","","","0.2249","0.2505","","","","","","1.459","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079576","8.3321","0.0008","9.0137","0.0009","11.2232","0.0013","96.331","0.004","97.728","0.004","97.406","0.007","821.26","0.15","123","","123","","","","","","","","LOC ETH Zurich","4","P -1","-P 1","2","","","","- C16 H6 F12 Zn -","- C16 H6 F12 Zn -","- C32 H12 F24 Zn2 -","2","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.0787","0.0544","","","0.1372","0.158","","","","","","0.938","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079577","8.0748","0.0001","8.2184","0.0001","19.4944","0.0004","85.3479","0.0007","79.6964","0.0007","85.5089","0.0009","1265.94","0.03","173","","","","","","","","","","LOC ETH Zurich","4","P -1","-P 1","2","","","","- C16 H6 F12 Zn -","- C16 H6 F12 Zn -","- C48 H18 F36 Zn3 -","3","1.5","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.0587","0.0488","","","0.1552","0.1656","","","","","","1.239","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079578","4.9059","0.0002","14.4229","0.0006","29.9958","0.0014","90","","94.3779","0.0013","90","","2116.23","0.16","173","","","","","","","","","","LOC ETH Zurich","5","P 1 21/c 1","-P 2ybc","14","","(3,5-bis(trifluoromethyl)phenyl)trioxorhenium","","- C8 H3 F6 O3 Re -","- C8 H3 F6 O3 Re -","- C64 H24 F48 O24 Re8 -","8","2","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.0956","0.0563","","","0.1381","0.1625","","","","","","0.976","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079579","6.4296","0.0002","9.5288","0.0003","10.3429","0.0004","71.8948","0.0013","85.6748","0.0013","80.0861","0.0014","593.14","0.04","223","","","","","","","","","","LOC ETH Zurich","5","P -1","-P 1","2","","","","- C10 H8 F5 O4 Re -","- C10 H8 F5 O4 Re -","- C20 H16 F10 O8 Re2 -","2","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.0531","0.0485","","","0.1278","0.1344","","","","","","0.949","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079580","11.491","0.002","9.349","0.002","19.309","0.003","90","","98.205","0.007","90","","2053.1","0.7","173","","","","","","","","","","LOC ETH Zurich","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H3 B F15 O3 Re -","- C19 H3 B F15 O3 Re -","- C76 H12 B4 F60 O12 Re4 -","4","1","","Lai, Yu-Ying; Bornand, Marc; Chen, Peter","Homogeneous Model Complexes for Supported Rhenia Metathesis Catalysts","Organometallics","2012","31","21","7558","","10.1021/om300852s","","","0.71073","MoKα","","0.1546","0.0971","","","0.2223","0.2532","","","","","","1.337","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079581","12.1771","0.0009","22.5073","0.0016","21.2123","0.0014","90","","90.543","0.006","90","","5813.5","0.7","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 Al F36 Ga O4 Si2 -","- C40 H54 Al F36 Ga O4 Si2 -","- C160 H216 Al4 F144 Ga4 O16 Si8 -","4","1","","Budanow, Alexandra; Sinke, Tanja; Tillmann, Jan; Bolte, Michael; Wagner, Matthias; Lerner, Hans-Wolfram","Two-Coordinate Gallium Ion [tBu3Si-Ga-SitBu3]+and the Halonium Ions [tBu3Si-X-SitBu3]+(X = Br, I): Sources of the Supersilyl Cation [tBu3Si]+","Organometallics","2012","31","20","7298","","10.1021/om300854e","","","0.71073","MoKα","","0.175","0.1191","","","0.286","0.321","","","","","","1.045","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079582","9.6557","0.0008","10.7803","0.0009","19.4906","0.0017","83.319","0.002","79.01","0.002","73.73","0.002","1907.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H47 N O2 W -","- C45 H47 N O2 W -","- C90 H94 N2 O4 W2 -","2","1","","Peryshkov, Dmitry V.; Schrock, Richard R.","Synthesis of Tungsten Oxo Alkylidene Complexes","Organometallics","2012","31","20","7278","","10.1021/om3008579","","","0.71073","MoKα","","0.0254","0.0209","","","0.0463","0.0479","","","","","","1.028","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4079583","12.0498","0.0005","21.0063","0.001","17.9963","0.0008","90","","95.365","0.001","90","","4535.3","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49 H46 F10 N O2 P W -","- C49 H46 F10 N O2 P W -","- C196 H184 F40 N4 O8 P4 W4 -","4","1","","Peryshkov, Dmitry V.; Schrock, Richard R.","Synthesis of Tungsten Oxo Alkylidene Complexes","Organometallics","2012","31","20","7278","","10.1021/om3008579","","","0.71073","MoKα","","0.0297","0.0259","","","0.0559","0.0573","","","","","","1.066","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079584","9.3385","0.001","12.9036","0.0014","15.714","0.0018","91.207","0.002","92.359","0.002","99.81","0.002","1863.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H58 O3 Si W -","- C39 H58 O3 Si W -","- C78 H116 O6 Si2 W2 -","2","1","","Peryshkov, Dmitry V.; Schrock, Richard R.","Synthesis of Tungsten Oxo Alkylidene Complexes","Organometallics","2012","31","20","7278","","10.1021/om3008579","","","0.71073","MoKα","","0.0338","0.0255","","","0.0506","0.0531","","","","","","1.028","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079585","15.1114","0.0007","15.4585","0.0007","17.5246","0.0008","90","","96.535","0.001","90","","4067.1","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C49 H53 O3 W -","- C49 H51.4212 O3 W -","- C196 H205.685 O12 W4 -","4","1","","Peryshkov, Dmitry V.; Schrock, Richard R.","Synthesis of Tungsten Oxo Alkylidene Complexes","Organometallics","2012","31","20","7278","","10.1021/om3008579","","","0.71073","MoKα","","0.0481","0.0409","","","0.0803","0.0824","","","","","","1.21","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079586","22.8075","0.0009","7.9164","0.0003","10.481","0.0004","90","","96.834","0.002","90","","1878.93","0.13","150","2","150","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C31 H36 Br2 F12 N2 O P2 Pd2 -","- C31 H36 Br2 F12 N2 O P2 Pd2 -","- C62 H72 Br4 F24 N4 O2 P4 Pd4 -","2","0.5","","Mantas-Öktem, Kevser; Öfele, Karl; Pöthig, Alexander; Bechlars, Bettina; Herrmann, Wolfgang A.; Kühn, Fritz E.","Reactions of Nitrogen Donors with Cycloheptatrienylidene Complexes: Metal Coordination versus Nucleophilic Attack on the Carbene Ligand","Organometallics","2012","31","23","8249","","10.1021/om300867g","","","0.71073","MoKα","","0.0197","0.0192","","","0.0485","0.0487","","","","","","1.045","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079587","21.9709","0.0011","9.1344","0.0005","9.2153","0.0005","90","","90","","90","","1849.43","0.17","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C15 H17 Br2 Cl2 N Pd -","- C15 H17 Br2 Cl2 N Pd -","- C60 H68 Br8 Cl8 N4 Pd4 -","4","0.5","","Mantas-Öktem, Kevser; Öfele, Karl; Pöthig, Alexander; Bechlars, Bettina; Herrmann, Wolfgang A.; Kühn, Fritz E.","Reactions of Nitrogen Donors with Cycloheptatrienylidene Complexes: Metal Coordination versus Nucleophilic Attack on the Carbene Ligand","Organometallics","2012","31","23","8249","","10.1021/om300867g","","","0.71073","MoKα","","0.0241","0.0225","","","0.0511","0.0523","","","","","","1.138","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079588","5.6405","0.0002","8.1669","0.0003","14.238","0.0005","87.7186","0.0013","88.2397","0.0012","80.5587","0.0013","646.29","0.04","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H12 Br2 N2 Pd -","- C11 H12 Br2 N2 Pd -","- C22 H24 Br4 N4 Pd2 -","2","1","","Mantas-Öktem, Kevser; Öfele, Karl; Pöthig, Alexander; Bechlars, Bettina; Herrmann, Wolfgang A.; Kühn, Fritz E.","Reactions of Nitrogen Donors with Cycloheptatrienylidene Complexes: Metal Coordination versus Nucleophilic Attack on the Carbene Ligand","Organometallics","2012","31","23","8249","","10.1021/om300867g","","x-ray","0.71073","MoKα","","0.0142","0.0127","","","0.0286","0.0291","","","","","","1.046","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079589","7.6656","0.0002","14.1637","0.0003","24.7041","0.0006","90","","92.9724","0.001","90","","2678.6","0.11","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Br4 N4 O2 Pd3 -","- C22 H24 Br4 N4 O2 Pd3 -","- C88 H96 Br16 N16 O8 Pd12 -","4","1","","Mantas-Öktem, Kevser; Öfele, Karl; Pöthig, Alexander; Bechlars, Bettina; Herrmann, Wolfgang A.; Kühn, Fritz E.","Reactions of Nitrogen Donors with Cycloheptatrienylidene Complexes: Metal Coordination versus Nucleophilic Attack on the Carbene Ligand","Organometallics","2012","31","23","8249","","10.1021/om300867g","","x-ray","0.71073","MoKα","","0.04","0.0347","","","0.0815","0.0837","","","","","","1.046","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079590","9.5527","0.0009","10.1487","0.0009","22.1979","0.0016","89.341","0.003","82.406","0.003","64.476","0.003","1922.5","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H28 Br4 N2 O2 Pd -","- C22 H28 Br4 N2 O2 Pd -","- C66 H84 Br12 N6 O6 Pd3 -","3","1.5","","Mantas-Öktem, Kevser; Öfele, Karl; Pöthig, Alexander; Bechlars, Bettina; Herrmann, Wolfgang A.; Kühn, Fritz E.","Reactions of Nitrogen Donors with Cycloheptatrienylidene Complexes: Metal Coordination versus Nucleophilic Attack on the Carbene Ligand","Organometallics","2012","31","23","8249","","10.1021/om300867g","","","0.71073","MoKα","","0.0242","0.0231","","","0.0644","0.0652","","","","","","1.121","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079591","12.5208","0.0002","18.2828","0.0003","24.9107","0.0005","90","","90","","90","","5702.44","0.17","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24.5 H13.5 Cl4.5 N7 O3 Re -","- C24.5 H13.5 Cl4.5 N7 O3 Re -","- C196 H108 Cl36 N56 O24 Re8 -","8","1","","Wright, Phillip J.; Muzzioli, Sara; Werrett, Melissa V.; Raiteri, Paolo; Skelton, Brian W.; Silvester, Debbie S.; Stagni, Stefano; Massi, Massimiliano","Synthesis, Photophysical and Electrochemical Investigation of Dinuclear Tetrazolato-Bridged Rhenium Complexes","Organometallics","2012","31","21","7566","","10.1021/om300870a","","","0.71073","MoKα","","0.0628","0.0437","","","0.0966","0.1026","","","","","","1.052","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079592","20.3187","0.0006","8.6848","0.0005","24.455","0.0007","90","","108.812","0.003","90","","4084.9","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H12 N7 O3 Re -","- C21 H12 N7 O3 Re -","- C168 H96 N56 O24 Re8 -","8","1","","Wright, Phillip J.; Muzzioli, Sara; Werrett, Melissa V.; Raiteri, Paolo; Skelton, Brian W.; Silvester, Debbie S.; Stagni, Stefano; Massi, Massimiliano","Synthesis, Photophysical and Electrochemical Investigation of Dinuclear Tetrazolato-Bridged Rhenium Complexes","Organometallics","2012","31","21","7566","","10.1021/om300870a","","","0.71073","MoKα","","0.0411","0.0267","","","0.051","0.0525","","","","","","0.858","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079593","11.5325","0.0003","14.999","0.0005","16.5483","0.0004","90","","95.276","0.002","90","","2850.33","0.14","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 F6 N7 O3 P Re -","- C25 H21 F6 N7 O3 P Re -","- C100 H84 F24 N28 O12 P4 Re4 -","4","1","","Wright, Phillip J.; Muzzioli, Sara; Werrett, Melissa V.; Raiteri, Paolo; Skelton, Brian W.; Silvester, Debbie S.; Stagni, Stefano; Massi, Massimiliano","Synthesis, Photophysical and Electrochemical Investigation of Dinuclear Tetrazolato-Bridged Rhenium Complexes","Organometallics","2012","31","21","7566","","10.1021/om300870a","","","0.71073","MoKα","","0.0677","0.0337","","","0.0555","0.0591","","","","","","0.861","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079594","11.276","0.005","13.079","0.005","14.516","0.005","92.17","0.005","92.134","0.005","99.976","0.005","2104.8","1.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H26 F6 N9 O7 P Re2 -","- C41 H26 F6 N9 O7 P Re2 -","- C82 H52 F12 N18 O14 P2 Re4 -","2","1","","Wright, Phillip J.; Muzzioli, Sara; Werrett, Melissa V.; Raiteri, Paolo; Skelton, Brian W.; Silvester, Debbie S.; Stagni, Stefano; Massi, Massimiliano","Synthesis, Photophysical and Electrochemical Investigation of Dinuclear Tetrazolato-Bridged Rhenium Complexes","Organometallics","2012","31","21","7566","","10.1021/om300870a","","","0.71073","MoKα","","0.0794","0.0497","","","0.1099","0.1192","","","","","","1.064","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4079595","13.5106","0.0011","13.9668","0.0012","14.3512","0.001","72.813","0.007","63.262","0.008","75.253","0.007","2286.9","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C38.5 H25 Cl5 F6 N9 O6 P Re2 -","- C38.5 H25 Cl5 F6 N9 O6 P Re2 -","- C77 H50 Cl10 F12 N18 O12 P2 Re4 -","2","1","","Wright, Phillip J.; Muzzioli, Sara; Werrett, Melissa V.; Raiteri, Paolo; Skelton, Brian W.; Silvester, Debbie S.; Stagni, Stefano; Massi, Massimiliano","Synthesis, Photophysical and Electrochemical Investigation of Dinuclear Tetrazolato-Bridged Rhenium Complexes","Organometallics","2012","31","21","7566","","10.1021/om300870a","","","0.71073","MoKα","","0.1446","0.0593","","","0.1044","0.1165","","","","","","0.803","","","","has coordinates,has disorder","287892","2023-11-30","16:04:10",""
"4079596","15.9559","0.0006","11.4221","0.0004","21.7288","0.0008","90","","90","","90","","3960.1","0.3","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H30 N3 P -","- C19 H30 N3 P -","- C152 H240 N24 P8 -","8","1","","Marchenko, Anatoliy P.; Koidan, Heorgiy N.; Zarudnitskii, Evgeniy V.; Hurieva, Anastasiya N.; Kirilchuk, Andrey A.; Yurchenko, Aleksandr A.; Biffis, Andrea; Kostyuk, Aleksandr N.","Stable N-Phosphorylated 1,2,4-Triazol-5-ylidenes: Novel Ligands for Metal Complexes","Organometallics","2012","31","23","8257","","10.1021/om300872g","","","0.71073","MoKα","","0.1157","0.0632","","","0.1354","0.1579","","","","","","1.008","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079597","23.6688","0.0008","11.2177","0.0003","22.725","0.0011","90","","114.363","0.001","90","","5496.4","0.4","173","2","173","2","","","","","","","","8","C 1 c 1","C -2yc","9","","","","- C44 H65 Ag2 F6 N9 O6 P2 S2 -","- C44 H65 Ag2 F6 N9 O6 P2 S2 -","- C176 H260 Ag8 F24 N36 O24 P8 S8 -","4","1","","Marchenko, Anatoliy P.; Koidan, Heorgiy N.; Zarudnitskii, Evgeniy V.; Hurieva, Anastasiya N.; Kirilchuk, Andrey A.; Yurchenko, Aleksandr A.; Biffis, Andrea; Kostyuk, Aleksandr N.","Stable N-Phosphorylated 1,2,4-Triazol-5-ylidenes: Novel Ligands for Metal Complexes","Organometallics","2012","31","23","8257","","10.1021/om300872g","","","0.71073","MoKα","","0.0602","0.0468","","","0.0959","0.1032","","","","","","1.019","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079598","12.7925","0.0004","15.2069","0.0005","14.7165","0.0005","90","","108.833","0.0017","90","","2709.59","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C49 H62 Cl8 Cr2 N8 -","- C49 H62 Cl8 Cr2 N8 -","- C98 H124 Cl16 Cr4 N16 -","2","0.5","","Thagfi, Jameel Al; Lavoie, Gino G.","Preparation and Reactivity Study of Chromium(III), Iron(II), and Cobalt(II) Complexes of 1,3-Bis(imino)benzimidazol-2-ylidene and 1,3-Bis(imino)pyrimidin-2-ylidene","Organometallics","2012","31","21","7351","","10.1021/om300873k","","","1.54178","CuKα","","0.0465","0.0414","","","0.1087","0.113","","","","","","1.051","","","","has coordinates,has disorder","178684","2020-10-21","18:00:00",""
"4079599","12.373","0.004","12.529","0.002","24.461","0.005","90","","90","","90","","3792","1.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H30 Cl2 Ni P2 -","- C14 H30 Cl2 Ni P2 -","- C112 H240 Cl16 Ni8 P16 -","8","2","","Donets, Pavel A.; Saget, Tanguy; Cramer, Nicolai","Chiral Monodentate Trialkylphosphines Based on the Phospholane Architecture","Organometallics","2012","31","23","8040","","10.1021/om3008772","","","0.71073","MoKα","","0.071","0.0638","","","0.1619","0.1761","","","","","","1.065","","","","has coordinates","178684","2020-10-21","18:00:00",""
"4079600","8.298","0.003","19.97","0.006","8.468","0.002","90","","105.993","0.016","90","","1348.9","0.7","140","2","140","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H46 Cl2 P2 Pd -","- C24 H46 Cl2 P2 Pd -","- C48 H92 Cl4 P4 Pd2 -","2","1","","Donets, Pavel A.; Saget, Tanguy; Cramer, Nicolai","Chiral Monodentate Trialkylphosphines Based on the Phospholane Architecture","Organometallics","2012","31","23","8040","","10.1021/om3008772","","","0.71073","MoKα","","0.0759","0.0658","","","0.1758","0.1914","","","","","","0.976","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079601","8.5322","0.0002","12.0949","0.0003","22.4379","0.0005","90","","90","","90","","2315.5","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H38 Cl2 P2 Pd -","- C18 H38 Cl2 P2 Pd -","- C72 H152 Cl8 P8 Pd4 -","4","1","","Donets, Pavel A.; Saget, Tanguy; Cramer, Nicolai","Chiral Monodentate Trialkylphosphines Based on the Phospholane Architecture","Organometallics","2012","31","23","8040","","10.1021/om3008772","","","0.71073","MoKα","","0.0424","0.0307","","","0.0541","0.0597","","","","","","1.049","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079602","8.503","0.0003","13.0765","0.0005","22.5786","0.0008","90","","90","","90","","2510.5","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H42 Cl2 P2 Pd -","- C20 H42 Cl2 P2 Pd -","- C80 H168 Cl8 P8 Pd4 -","4","1","","Donets, Pavel A.; Saget, Tanguy; Cramer, Nicolai","Chiral Monodentate Trialkylphosphines Based on the Phospholane Architecture","Organometallics","2012","31","23","8040","","10.1021/om3008772","","","0.71073","MoKα","","0.0707","0.0533","","","0.1249","0.1379","","","","","","1.04","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079603","8.0418","0.0003","10.5872","0.0004","22.0696","0.0009","90","","90","","90","","1879.01","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H30 Cl2 P2 Pd -","- C14 H30 Cl2 P2 Pd -","- C56 H120 Cl8 P8 Pd4 -","4","1","","Donets, Pavel A.; Saget, Tanguy; Cramer, Nicolai","Chiral Monodentate Trialkylphosphines Based on the Phospholane Architecture","Organometallics","2012","31","23","8040","","10.1021/om3008772","","","0.71073","MoKα","","0.0755","0.0457","","","0.0732","0.0842","","","","","","1.049","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079604","13.924","0.003","11.621","0.002","15.686","0.003","90","","102.12","0.03","90","","2481.6","0.9","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H66 N4 O2 P2 Si2 -","- C54 H66 N4 O2 P2 Si2 -","- C108 H132 N8 O4 P4 Si4 -","2","0.5","","Azhakar, Ramachandran; Pröpper, Kevin; Dittrich, Birger; Roesky, Herbert W.","Reactivity Studies of Heteroleptic Silylenes with N2O","Organometallics","2012","31","21","7586","","10.1021/om3008794","","","1.54178","CuKα","","0.036","0.0343","","","0.0897","0.091","","","","","","1.04","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079605","12.4224","0.0003","11.5174","0.0003","21.055","0.0006","90","","101.291","0.001","90","","2954.11","0.13","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C68 H82 N6 O2 Si2 -","- C68 H82 N6 O2 Si2 -","- C136 H164 N12 O4 Si4 -","2","0.5","","Azhakar, Ramachandran; Pröpper, Kevin; Dittrich, Birger; Roesky, Herbert W.","Reactivity Studies of Heteroleptic Silylenes with N2O","Organometallics","2012","31","21","7586","","10.1021/om3008794","","","1.54178","CuKα","","0.0403","0.036","","","0.1026","0.1195","","","","","","1.163","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079606","10.0862","0.0002","17.4581","0.0004","11.1872","0.0003","90","","111.728","0.001","90","","1829.95","0.08","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H58 N6 O2 Si2 -","- C34 H58 N6 O2 Si2 -","- C68 H116 N12 O4 Si4 -","2","1","","Azhakar, Ramachandran; Pröpper, Kevin; Dittrich, Birger; Roesky, Herbert W.","Reactivity Studies of Heteroleptic Silylenes with N2O","Organometallics","2012","31","21","7586","","10.1021/om3008794","","","1.54178","CuKα","","0.0307","0.0306","","","0.0843","0.0844","","","","","","1.054","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079607","17.9505","0.0003","10.5143","0.0002","61.5855","0.0012","90","","90.35","0.001","90","","11623.2","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H64 N4 O4 Si2 -","- C38 H64 N4 O4 Si2 -","- C456 H768 N48 O48 Si24 -","12","1.5","","Azhakar, Ramachandran; Pröpper, Kevin; Dittrich, Birger; Roesky, Herbert W.","Reactivity Studies of Heteroleptic Silylenes with N2O","Organometallics","2012","31","21","7586","","10.1021/om3008794","","","1.54178","CuKα","","0.0414","0.0363","","","0.0868","0.0909","","","","","","1.061","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079608","8.7409","0.0004","9.3138","0.0004","9.5751","0.0005","91.689","0.003","114.048","0.002","93.273","0.002","709.51","0.06","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H52 Mg2 O4 -","- C26 H52 Mg2 O4 -","- C26 H52 Mg2 O4 -","1","0.5","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.047","0.0406","","","0.1013","0.1092","","","","","","1.023","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079609","7.6841","0.0003","7.8489","0.0004","11.662","0.0007","85.92","0.003","82.19","0.003","70.24","0.003","655.56","0.06","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H24 Mg O2 -","- C12 H24 Mg O2 -","- C24 H48 Mg2 O4 -","2","1","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.0879","0.0628","","","0.1283","0.1395","","","","","","1.039","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079610","8.9828","0.0004","19.2048","0.0009","10.3053","0.0003","90","","96.62","0.003","90","","1765.94","0.13","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H64 Mg2 O4 -","- C32 H64 Mg2 O4 -","- C64 H128 Mg4 O8 -","2","0.5","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.0694","0.0542","","","0.1204","0.127","","","","","","1.11","","","","has coordinates","301830","2025-08-20","13:17:26",""
"4079611","19.5821","0.0004","10.7592","0.0002","18.7599","0.0004","90","","116.776","0.001","90","","3528.67","0.13","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H64 Mg2 O4 -","- C32 H64 Mg2 O4 -","- C128 H256 Mg8 O16 -","4","1","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.1167","0.0841","","","0.1948","0.219","","","","","","1.043","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079612","19.2359","0.0002","18.127","0.0003","14.9726","0.0002","90","","90.343","0.001","90","","5220.69","0.12","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H48 Li2 Mg N4 -","- C20 H48 Li2 Mg N4 -","- C160 H384 Li16 Mg8 N32 -","8","2","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.0968","0.078","","","0.1906","0.2063","","","","","","1.033","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079613","11.1834","0.0002","9.7428","0.0001","14.183","0.0003","90","","93.891","0.001","90","","1541.78","0.05","133","2","133","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H50 Li2 Mg N4 -","- C28 H50 Li2 Mg N4 -","- C56 H100 Li4 Mg2 N8 -","2","1","","Fischer, Reinald; Suxdorf, Regina; Görls, Helmar; Westerhausen, Matthias","Synthesis, Crystal Structures, and Solution Behavior of Organomagnesium Derivatives of Alkane-1,4-diide as Well as -1,5-diide","Organometallics","2012","31","21","7579","","10.1021/om300880f","","","0.71073","MoKα","","0.0379","0.0358","","","0.0828","0.0849","","","","","","1.089","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079614","19.304","0.002","12.9649","0.0017","31.376","0.004","90","","96.953","0.003","90","","7794.9","1.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C54 H38 Mo O2 -","- C54 H38 Mo O2 -","- C432 H304 Mo8 O16 -","8","2","","Adams, Harry; Brown, Patrick; Cook, Elizabeth S.; Hanson, Robert J.; Morris, Michael J.","Oligomerization of Phenylacetylene to Coordinated 2,3,6-Triphenylfulvene in Molybdenum Tetracyclone Complexes","Organometallics","2012","31","21","7622","","10.1021/om3008844","","","0.71073","MoKα","","0.1847","0.0657","","","0.1171","0.155","","","","","","0.919","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079615","12.2922","0.0011","12.6307","0.0012","18.1414","0.0019","106.951","0.006","90.423","0.006","108.238","0.005","2543.8","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H46 Cl2 Mo O2 -","- C58 H46 Cl2 Mo O2 -","- C116 H92 Cl4 Mo2 O4 -","2","1","","Adams, Harry; Brown, Patrick; Cook, Elizabeth S.; Hanson, Robert J.; Morris, Michael J.","Oligomerization of Phenylacetylene to Coordinated 2,3,6-Triphenylfulvene in Molybdenum Tetracyclone Complexes","Organometallics","2012","31","21","7622","","10.1021/om3008844","","","0.71073","MoKα","","0.0767","0.0496","","","0.1236","0.1342","","","","","","0.966","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079616","33.015","0.002","14.7148","0.001","17.6141","0.0012","90","","107.621","0.004","90","","8155.6","0.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H53 Cl5 Fe N4 -","- C36 H53 Cl5 Fe N4 -","- C288 H424 Cl40 Fe8 N32 -","8","1","","Kaplan, Hilan Z.; Li, Bo; Byers, Jeffery A.","Synthesis and Characterization of a Bis(imino)-N-heterocyclic Carbene Analogue to Bis(imino)pyridine Iron Complexes","Organometallics","2012","31","21","7343","","10.1021/om300885d","","","0.71073","MoKα","","0.0679","0.0498","","","0.1229","0.1354","","","","","","1.022","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079617","21.4058","0.0009","21.4058","0.0009","35.1534","0.0016","90","","90","","90","","16107.6","1.2","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C34.25 H50.5 Cl6.5 Fe N4 -","- C34.25 H50.5 Cl6.5 Fe N4 -","- C548 H808 Cl104 Fe16 N64 -","16","1","","Kaplan, Hilan Z.; Li, Bo; Byers, Jeffery A.","Synthesis and Characterization of a Bis(imino)-N-heterocyclic Carbene Analogue to Bis(imino)pyridine Iron Complexes","Organometallics","2012","31","21","7343","","10.1021/om300885d","","","0.71073","MoKα","","0.0559","0.0433","","","0.1152","0.1253","","","","","","1.078","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079618","31.4145","0.0011","16.7828","0.0005","15.8496","0.0005","90","","97.13","0.002","90","","8291.7","0.5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H46 Cl2 Fe N4 -","- C33 H46 Cl2 Fe N4 -","- C264 H368 Cl16 Fe8 N32 -","8","1","","Kaplan, Hilan Z.; Li, Bo; Byers, Jeffery A.","Synthesis and Characterization of a Bis(imino)-N-heterocyclic Carbene Analogue to Bis(imino)pyridine Iron Complexes","Organometallics","2012","31","21","7343","","10.1021/om300885d","","","0.71073","MoKα","","0.0928","0.0609","","","0.1755","0.1956","","","","","","1.096","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079619","9.2047","0.0005","16.1146","0.0009","26.2389","0.0015","90","","95.821","0.004","90","","3871.9","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H110 Cl6 Fe2 N8 O2 -","- C72 H110 Cl6 Fe2 N8 O2 -","- C144 H220 Cl12 Fe4 N16 O4 -","2","0.5","","Kaplan, Hilan Z.; Li, Bo; Byers, Jeffery A.","Synthesis and Characterization of a Bis(imino)-N-heterocyclic Carbene Analogue to Bis(imino)pyridine Iron Complexes","Organometallics","2012","31","21","7343","","10.1021/om300885d","","","0.71073","MoKα","","0.1592","0.0758","","","0.1602","0.1861","","","","","","1.028","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079620","9.888","0.0002","10.87","0.0003","13.5542","0.0003","90","","108.792","0.002","90","","1379.18","0.06","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H26 F6 N6 O6 S2 -","- C22 H26 F6 N6 O6 S2 -","- C44 H52 F12 N12 O12 S4 -","2","0.5","","Grohmann, Christoph; Hashimoto, Takayoshi; Fröhlich, Roland; Ohki, Yasuhiro; Tatsumi, Kazuyuki; Glorius, Frank","An Iron(II) Complex of a Diamine-Bridged Bis-N-Heterocyclic Carbene","Organometallics","2012","31","23","8047","","10.1021/om300888q","","","0.71073","MoKα","","0.095","0.0883","","","0.245","0.2508","","","","","","1.117","","","","has coordinates,has disorder","301830","2025-08-20","13:17:26",""
"4079621","10.495","0.004","10.897","0.005","11.448","0.005","115.502","0.008","91.326","0.006","90.984","0.004","1180.8","0.9","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H27 Cl2 Fe N7 -","- C22 H27 Cl2 Fe N7 -","- C44 H54 Cl4 Fe2 N14 -","2","1","","Grohmann, Christoph; Hashimoto, Takayoshi; Fröhlich, Roland; Ohki, Yasuhiro; Tatsumi, Kazuyuki; Glorius, Frank","An Iron(II) Complex of a Diamine-Bridged Bis-N-Heterocyclic Carbene","Organometallics","2012","31","23","8047","","10.1021/om300888q","","","0.7107","MoKα","","","0.0276","","","","0.0686","","","","","","1.023","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079622","37.562","0.005","12.3451","0.0015","24.9","0.003","90","","105.618","0.001","90","","11120","2","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H35 Au F6 O P Sb -","- C24 H34 Au F6 O P Sb -","- C384 H544 Au16 F96 O16 P16 Sb16 -","16","2","","Zhu, Yuyang; Day, Cynthia S.; Jones, Amanda C.","Synthesis and Structure of Cationic Phosphine Gold(I) Enol Ether Complexes","Organometallics","2012","31","21","7332","","10.1021/om300893q","","","0.71073","MoKα","","0.0485","0.0377","","","0.0897","0.096","","","","","","1.028","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079623","9.0067","0.0009","25.08","0.002","11.9594","0.0011","90","","92.596","0.001","90","","2698.7","0.4","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H33 Au F6 O P Sb -","- C24 H33 Au F6 O P Sb -","- C96 H132 Au4 F24 O4 P4 Sb4 -","4","1","","Zhu, Yuyang; Day, Cynthia S.; Jones, Amanda C.","Synthesis and Structure of Cationic Phosphine Gold(I) Enol Ether Complexes","Organometallics","2012","31","21","7332","","10.1021/om300893q","","","0.71073","MoKα","","0.0299","0.0251","","","0.0624","0.0646","","","","","","1.028","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079624","11.7396","0.0015","14.8313","0.0019","16.241","0.002","90","","92.386","0.001","90","","2825.3","0.6","193","2","193","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C25 H35 Au F6 O P Sb -","- C25 H35 Au F6 O P Sb -","- C100 H140 Au4 F24 O4 P4 Sb4 -","4","1","","Zhu, Yuyang; Day, Cynthia S.; Jones, Amanda C.","Synthesis and Structure of Cationic Phosphine Gold(I) Enol Ether Complexes","Organometallics","2012","31","21","7332","","10.1021/om300893q","","","0.71073","MoKα","","0.0429","0.0359","","","0.077","0.0812","","","","","","0.873","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079625","8.2207","0.0012","15.516","0.002","9.7572","0.0014","90","","111.486","0.001","90","","1158.1","0.3","193","2","193","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C16 H35 Au F6 O P Sb -","- C16 H35 Au F6 O P Sb -","- C32 H70 Au2 F12 O2 P2 Sb2 -","2","1","","Zhu, Yuyang; Day, Cynthia S.; Jones, Amanda C.","Synthesis and Structure of Cationic Phosphine Gold(I) Enol Ether Complexes","Organometallics","2012","31","21","7332","","10.1021/om300893q","","","0.71073","MoKα","","0.0322","0.0299","","","0.0757","0.0777","","","","","","1.051","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079626","8.3567","0.0006","10.0489","0.0007","30.09","0.002","90","","90","","90","","2526.8","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 Br N O6 -","- C26 H26 Br N O6 -","- C104 H104 Br4 N4 O24 -","4","1","","Mei, Liang-yong; Wei, Yin; Xu, Qin; Shi, Min","Palladium-Catalyzed Asymmetric Formal [3+2] Cycloaddition of Vinyl Cyclopropanes and β,γ-Unsaturated α-Keto Esters: An Effective Route to Highly Functionalized Cyclopentanes","Organometallics","2012","31","21","7591","","10.1021/om300896z","","","0.71073","MoKα","","0.0806","0.045","","","0.0974","0.1104","","","","","","0.974","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079627","7.746","0.0002","18.6267","0.0004","19.007","0.0004","90","","90","","90","","2742.38","0.11","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H23 N O5 -","- C22 H23 N O5 -","- C88 H92 N4 O20 -","4","1","","Mei, Liang-yong; Wei, Yin; Xu, Qin; Shi, Min","Palladium-Catalyzed Asymmetric Formal [3+2] Cycloaddition of Vinyl Cyclopropanes and β,γ-Unsaturated α-Keto Esters: An Effective Route to Highly Functionalized Cyclopentanes","Organometallics","2012","31","21","7591","","10.1021/om300896z","","","1.54178","CuKα","","0.0499","0.0462","","","0.1501","0.1542","","","","","","1.081","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079628","9.2083","0.0005","6.8855","0.0004","13.8057","0.0007","90","","92.474","0.003","90","","874.52","0.08","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H18 N2 O3 -","- C19 H18 N2 O3 -","- C38 H36 N4 O6 -","2","1","","Mei, Liang-yong; Wei, Yin; Xu, Qin; Shi, Min","Palladium-Catalyzed Asymmetric Formal [3+2] Cycloaddition of Vinyl Cyclopropanes and β,γ-Unsaturated α-Keto Esters: An Effective Route to Highly Functionalized Cyclopentanes","Organometallics","2012","31","21","7591","","10.1021/om300896z","","","1.54178","CuKα","","0.034","0.0332","","","0.0931","0.0944","","","","","","1.027","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079629","10.2295","0.0003","17.7567","0.0006","16.1458","0.0004","90","","90.3761","0.0019","90","","2932.69","0.15","200","","200","","","","","","","","Research Shool of Chemistry","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H32 N2 P2 -","- C37 H32 N2 P2 -","- C148 H128 N8 P8 -","4","1","","Hill, Anthony F.; McQueen, Caitlin M. A.","Dihydroperimidine-Derived N-Heterocyclic Pincer Carbene Complexes via Double C–H Activation","Organometallics","2012","31","23","8051","","10.1021/om300897w","","","0.71073","MoKα","","0.0633","0.05","","0.1081","0.1033","0.1081","","","","","","1.0794","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079630","16.8797","0.0007","11.895","0.0007","18.4555","0.0008","90","","115.196","0.002","90","","3353","0.3","200","","200","","","","","","","","local","4","P 1 21/a 1","-P 2yab","14","","","","- C37 H56 N2 P2 -","- C37 H56 N2 P2 -","- C148 H224 N8 P8 -","4","1","","Hill, Anthony F.; McQueen, Caitlin M. A.","Dihydroperimidine-Derived N-Heterocyclic Pincer Carbene Complexes via Double C‒H Activation","Organometallics","2012","31","23","8051","","10.1021/om300897w","","","0.71073","MoKα","","0.1169","0.0928","","0.2283","0.2147","0.2283","","","","","","1.0155","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079631","26.6194","0.0004","26.6194","0.0004","27.22","0.0005","90","","90","","120","","16703.8","0.5","200","","200","","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C37 H54 Cl N2 P2 Rh -","- C37 H54 Cl N2 P2 Rh -","- C666 H972 Cl18 N36 P36 Rh18 -","18","0.5","","Hill, Anthony F.; McQueen, Caitlin M. A.","Dihydroperimidine-Derived N-Heterocyclic Pincer Carbene Complexes via Double C‒H Activation","Organometallics","2012","31","23","8051","","10.1021/om300897w","","","0.71073","MoKα","","0.063","0.0499","","0.1208","0.1103","0.1208","","","","","","0.9753","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079632","15.3069","0.0003","13.9062","0.0004","21.5639","0.0006","90","","108.384","0.0013","90","","4355.8","0.2","200","","200","","","","","","","","local","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H64 Cl Ir N2 O2 P2 -","- C42 H64 Cl Ir N2 O2 P2 -","- C168 H256 Cl4 Ir4 N8 O8 P8 -","4","1","","Hill, Anthony F.; McQueen, Caitlin M. A.","Dihydroperimidine-Derived N-Heterocyclic Pincer Carbene Complexes via Double C‒H Activation","Organometallics","2012","31","23","8051","","10.1021/om300897w","","","0.71073","MoKα","","0.0664","0.0385","","0.0831","0.0764","0.0831","","","","","","0.9288","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079633","18.8327","0.0002","20.8326","0.0003","24.1535","0.0003","90","","107.858","0.0008","90","","9019.7","0.2","200","","200","","","","","","","","local","8","C 1 2/c 1","-C 2yc","15","","","","- C38 H55 Cl F2 Ir N2 O3 P3 -","- C38 H55 Cl F2 Ir N2 O3 P3 -","- C304 H440 Cl8 F16 Ir8 N16 O24 P24 -","8","1","","Hill, Anthony F.; McQueen, Caitlin M. A.","Dihydroperimidine-Derived N-Heterocyclic Pincer Carbene Complexes via Double C‒H Activation","Organometallics","2012","31","23","8051","","10.1021/om300897w","","","0.71073","MoKα","","0.0416","0.0323","","0.0896","0.0847","0.0896","","","","","","1.0085","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079634","14.2981","0.0004","10.766","0.0002","25.511","0.0007","90","","92.774","0.002","90","","3922.39","0.17","133","2","133","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C42 H37 B Cl2 F4 N2 P2 Pd -","- C42 H37 B Cl2 F4 N2 P2 Pd -","- C168 H148 B4 Cl8 F16 N8 P8 Pd4 -","4","1","","Guo, Tongxun; Dechert, Sebastian; Meyer, Steffen; Meyer, Franc","Convenient Synthetic Route to Palladium Complexes of Unconventional N-Heterocyclic Carbenes Derived from Pyridazine and Phthalazine","Organometallics","2012","31","24","8537","","10.1021/om300899r","","","0.71073","MoKα","","0.0347","0.0282","","","0.066","0.0682","","","","","","1.017","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079635","20.2183","0.0004","14.8686","0.0004","15.0359","0.0003","90","","90","","90","","4520.06","0.18","133","2","133","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C47 H41 B Cl4 F4 N2 P2 Pd -","- C47 H41 B Cl4 F4 N2 P2 Pd -","- C188 H164 B4 Cl16 F16 N8 P8 Pd4 -","4","0.5","","Guo, Tongxun; Dechert, Sebastian; Meyer, Steffen; Meyer, Franc","Convenient Synthetic Route to Palladium Complexes of Unconventional N-Heterocyclic Carbenes Derived from Pyridazine and Phthalazine","Organometallics","2012","31","24","8537","","10.1021/om300899r","","","0.71073","MoKα","","0.0637","0.0508","","","0.1181","0.1246","","","","","","1.072","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079636","9.6593","0.0009","10.9025","0.001","13.1195","0.0012","114.633","0.006","106.394","0.007","89.521","0.007","1195.3","0.2","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H22 Cl3 N2 P Pd -","- C24 H22 Cl3 N2 P Pd -","- C48 H44 Cl6 N4 P2 Pd2 -","2","1","","Guo, Tongxun; Dechert, Sebastian; Meyer, Steffen; Meyer, Franc","Convenient Synthetic Route to Palladium Complexes of Unconventional N-Heterocyclic Carbenes Derived from Pyridazine and Phthalazine","Organometallics","2012","31","24","8537","","10.1021/om300899r","","","0.71073","MoKα","","0.0259","0.0217","","","0.0535","0.0548","","","","","","1.031","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079637","14.296","0.0005","10.4914","0.0002","32.2","0.0012","90","","97.243","0.003","90","","4791","0.3","133","2","133","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C48 H46 B Cl3 F4 N4 P2 Pd -","- C48 H46 B Cl3 F4 N4 P2 Pd -","- C192 H184 B4 Cl12 F16 N16 P8 Pd4 -","4","1","","Guo, Tongxun; Dechert, Sebastian; Meyer, Steffen; Meyer, Franc","Convenient Synthetic Route to Palladium Complexes of Unconventional N-Heterocyclic Carbenes Derived from Pyridazine and Phthalazine","Organometallics","2012","31","24","8537","","10.1021/om300899r","","","0.71073","MoKα","","0.0669","0.0528","","","0.1352","0.1437","","","","","","1.047","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079638","15.0715","0.0017","18.818","0.002","15.2704","0.0017","90","","99.854","0.002","90","","4267","0.8","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H57 B Fe N2 O3 P2 -","- C47 H57 B Fe N2 O3 P2 -","- C188 H228 B4 Fe4 N8 O12 P8 -","4","1","","Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao","Change in Coordination of NCN Pincer Iron Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","23","8283","","10.1021/om300901k","","","0.71073","MoKα","","0.0688","0.0569","","","0.1262","0.1317","","","","","","1.119","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079639","9.374","0.004","10.985","0.005","12.126","0.005","89.317","0.011","73.436","0.01","82.832","0.01","1187.1","0.9","153","2","153","2","","","","","","","","7","P 1","P 1","1","","","","- C49 H61 B Fe N2 O3 P2 -","- C49 H61 B Fe N2 O3 P2 -","- C49 H61 B Fe N2 O3 P2 -","1","1","","Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao","Change in Coordination of NCN Pincer Iron Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","23","8283","","10.1021/om300901k","","","0.71073","MoKα","","0.0616","0.0475","","","0.0996","0.1041","","","","","","0.951","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079640","11.109","0.0016","9.2697","0.0014","32.13","0.005","90","","95.778","0.003","90","","3291.8","0.9","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 Br Fe N2 O3 P2 -","- C33 H41 Br Fe N2 O3 P2 -","- C132 H164 Br4 Fe4 N8 O12 P8 -","4","1","","Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao","Change in Coordination of NCN Pincer Iron Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","23","8283","","10.1021/om300901k","","","0.71073","MoKα","","0.0623","0.0495","","","0.1005","0.1072","","","","","","1.147","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079641","16.697","0.003","16.925","0.003","16.737","0.003","90","","94.476","0.006","90","","4715.4","1.5","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 Br Fe N3 O3 -","- C22 H28 Br Fe N3 O3 -","- C176 H224 Br8 Fe8 N24 O24 -","8","2","","Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao","Change in Coordination of NCN Pincer Iron Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","23","8283","","10.1021/om300901k","","","0.71073","MoKα","","0.1612","0.0864","","","0.1707","0.2181","","","","","","1.034","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079642","17.304","0.004","17.373","0.004","14.898","0.004","90","","90","","90","","4478.7","1.9","153","2","153","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C35 H54 Br Fe N5 O3 -","- C35 H19 Br Fe N5 O3 -","- C140 H76 Br4 Fe4 N20 O12 -","4","0.25","","Hosokawa, Satomi; Ito, Jun-ichi; Nishiyama, Hisao","Change in Coordination of NCN Pincer Iron Complexes Containing Bis(oxazolinyl)phenyl Ligands","Organometallics","2012","31","23","8283","","10.1021/om300901k","","","0.71073","MoKα","","0.1088","0.0781","","","0.2311","0.2513","","","","","","1.106","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079643","10.8651","0.0005","14.8098","0.0007","32.569","0.0013","90","","98.057","","90","","5188.9","0.4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H53 N6 O0.5 P2 Pd2 -","- C60 H48 N6 O0.5 P2 Pd2 -","- C240 H192 N24 O2 P8 Pd8 -","4","1","","Tsukada, Naofumi; Ohnishi, Nozomi; Aono, Shiori; Takahashi, Fusako","Amination of Aryl Iodides Catalyzed by a Palladium‒Copper Complex Supported by a Chelate-Bridging Ligand","Organometallics","2012","31","21","7336","","10.1021/om300902t","","","0.7107","MoKα","","","0.04","","","","0.088","","","","","","1.002","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079644","8.988","0.0019","16.463","0.004","18.052","0.004","90","","96.037","0.003","90","","2656.3","1","293","","293","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H25 Cl Cu N3 O P Pd -","- C29 H25 Cl Cu N3 O P Pd -","- C116 H100 Cl4 Cu4 N12 O4 P4 Pd4 -","4","1","","Tsukada, Naofumi; Ohnishi, Nozomi; Aono, Shiori; Takahashi, Fusako","Amination of Aryl Iodides Catalyzed by a Palladium‒Copper Complex Supported by a Chelate-Bridging Ligand","Organometallics","2012","31","21","7336","","10.1021/om300902t","","","0.7107","MoKα","","","0.0981","","","","0.2011","","","","","","1.072","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079645","15.897","0.003","17.898","0.004","22.069","0.004","90","","107.08","0.03","90","","6002","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H36 Cl2 N2 O4 Pt -","- C29 H36 Cl2 N2 O4 Pt -","- C232 H288 Cl16 N16 O32 Pt8 -","8","1","","Pellarin, Kyle R.; McCready, Matthew S.; Sutherland, Thomas I.; Puddephatt, Richard J.","Oxidative Addition of Phthaloyl Peroxide to Dimethylplatinum(II) Complexes","Organometallics","2012","31","23","8291","","10.1021/om3009074","","","0.71073","MoKα","","0.0726","0.046","","","0.1155","0.1427","","","","","","1.078","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079646","9.0456","0.0012","16.846","0.002","16.919","0.002","95.284","0.003","103.731","0.003","103.638","0.003","2403.7","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H27 N2 O9.5 Pt -","- C20 H18 N2 O9.5 Pt -","- C80 H72 N8 O38 Pt4 -","4","2","","Pellarin, Kyle R.; McCready, Matthew S.; Sutherland, Thomas I.; Puddephatt, Richard J.","Oxidative Addition of Phthaloyl Peroxide to Dimethylplatinum(II) Complexes","Organometallics","2012","31","23","8291","","10.1021/om3009074","","","0.71073","MoKα","","0.0872","0.0595","","","0.1428","0.1652","","","","","","0.882","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4079647","34.149","0.003","7.862","0.0006","16.3098","0.0013","90","","115.614","0.002","90","","3948.5","0.6","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H20 N2 O6 Pt -","- C21 H20 N2 O6 Pt -","- C168 H160 N16 O48 Pt8 -","8","1","","Pellarin, Kyle R.; McCready, Matthew S.; Sutherland, Thomas I.; Puddephatt, Richard J.","Oxidative Addition of Phthaloyl Peroxide to Dimethylplatinum(II) Complexes","Organometallics","2012","31","23","8291","","10.1021/om3009074","","","0.71073","MoKα","","0.0807","0.0442","","","0.1207","0.1427","","","","","","0.936","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079648","18.488","0.011","16.061","0.013","23.785","0.014","90","","108.99","0.07","90","","6678","8","140","1","140","1","","","","","","","","7","P 1 2/c 1","-P 2yc","13","Compound 1A1","","","- C112 H144 Ag4 Au4 F40 N8 O12 -","- C107.4 H82.4 Ag4 Au4 F40 N7.6 O12 -","- C214.8 H164.8 Ag8 Au8 F80 N15.2 O24 -","2","0.5","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71073","Mo-Kα","","0.1763","0.1178","","","0.2286","0.2485","","","","","","1.042","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079649","18.733","0.013","27.93","0.018","35.35","0.02","90","","90","","90","","18496","2","100","","100","","","","","","","","","7","P c n b","-P 2b 2ac","60","Compound 1A2","","","- C152 H180 Ag6 Au6 F60 N11 O18 -","- C131 H101.6 Ag6 Au6 F60 N7.6 O17.8 -","- C524 H406.4 Ag24 Au24 F240 N30.4 O71.2 -","4","0.5","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71075","MoKα","","0.1365","0.1135","","","0.1738","0.1832","","","","","","1.27","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079650","14.713","0.003","17.364","0.004","27.669","0.006","90","","90","","90","","7069","3","100","2","100","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","Compound 1B","","","- C73 H42 Ag2 Au2 Cl2 F20 N2 O6 P2 -","- C73 H42 Ag2 Au2 Cl2 F20 N2 O6 P2 -","- C292 H168 Ag8 Au8 Cl8 F80 N8 O24 P8 -","4","1","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71075","MoKα","","0.0565","0.0468","","","0.0673","0.0707","","","","","","0.985","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079651","21.737","0.003","43.49","0.009","44.52","0.009","90","","90","","90","","42087","13","100","","100","","","","","","","","","8","F d d d :2","-F 2uv 2vw","70","Compound 2A","","","- C43.25 H38.5 Ag2 Au2 Cl2.5 F23 N O2 -","- C44.15 H18 Ag2 Au2 Cl2.5 F23 N O2 -","- C1412.8 H576 Ag64 Au64 Cl80 F736 N32 O64 -","32","1","","Savjani, Nicky; Wilkinson, Luke A.; Hughes, David L.; Schormann, Mark; Bochmann, Manfred","Synthesis, Structure, and Luminescent Behavior of Anionic Oligomeric and Polymeric Ag2Au2Clusters","Organometallics","2012","31","21","7600","","10.1021/om300911h","","","0.71075","MoKα","","0.0811","0.0789","","","0.1508","0.1518","","","","","","1.332","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079652","11.7104","0.0002","14.4204","0.0002","13.0139","0.0002","90","","91.326","0.001","90","","2197.05","0.06","150","2","150","2","","","","","","","synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Cl N3 Ru -","- C20 H36 Cl N3 Ru -","- C80 H144 Cl4 N12 Ru4 -","4","1","","Garc\?ía-Álvarez, Rocío; Suárez, Francisco J.; D\?íez, Josefina; Crochet, Pascale; Cadierno, Victorio; Antiñolo, Antonio; Fernández-Galán, Rafael; Carrillo-Hermosilla, Fernando","Ruthenium(II) Arene Complexes with Asymmetrical Guanidinate Ligands: Synthesis, Characterization, and Application in the Base-Free Catalytic Isomerization of Allylic Alcohols","Organometallics","2012","31","23","8301","","10.1021/om3009124","","","1.5418","CuKα","","0.0316","0.026","","","0.0663","0.0733","","","","","","1.08","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079653","34.9253","0.0009","13.8742","0.0004","11.7132","0.0003","90","","107.197","0.003","90","","5422","0.3","150","","150","2","","","","","","","synthesis","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H42 Cl N3 Ru -","- C27 H42 Cl N3 Ru -","- C216 H336 Cl8 N24 Ru8 -","8","1","","Garc\?ía-Álvarez, Rocío; Suárez, Francisco J.; D\?íez, Josefina; Crochet, Pascale; Cadierno, Victorio; Antiñolo, Antonio; Fernández-Galán, Rafael; Carrillo-Hermosilla, Fernando","Ruthenium(II) Arene Complexes with Asymmetrical Guanidinate Ligands: Synthesis, Characterization, and Application in the Base-Free Catalytic Isomerization of Allylic Alcohols","Organometallics","2012","31","23","8301","","10.1021/om3009124","","","1.5418","CuKα","","0.0472","0.0408","","","0.1113","0.1183","","","","","","1.058","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079654","22.7034","0.0003","23.4596","0.0005","20.7205","0.0005","90","","121.283","0.001","90","","9431.5","0.3","293","2","293","2","","","","","","","synthesis as described","8","C 1 2/c 1","-C 2yc","15","","","","- C45 H38 Cl N3 O2 P2 Ru S -","- C45 H38 Cl N3 O2 P2 Ru S -","- C360 H304 Cl8 N24 O16 P16 Ru8 S8 -","8","1","","Kalaivani, P.; Prabhakaran, R.; Poornima, P.; Dallemer, F.; Vijayalakshmi, K.; Padma, V. Vijaya; Natarajan, K.","Versatile Coordination Behavior of Salicylaldehydethiosemicarbazone in Ruthenium(II) Carbonyl Complexes: Synthesis, Spectral, X-ray, Electrochemistry, DNA Binding, Cytotoxicity, and Cellular Uptake Studies","Organometallics","2012","31","23","8323","","10.1021/om300914n","","x-ray","0.71073","MoKα","","0.129","0.0583","","","0.1327","0.1526","","","","","","0.909","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079655","69.7414","0.0009","11.0337","0.0002","36.0149","0.0005","90","","106.464","0.001","90","","26577.4","0.7","293","2","293","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C45 H37 N3 O2 P2 Ru S -","- C45 H37 N3 O2 P2 Ru S -","- C1080 H888 N72 O48 P48 Ru24 S24 -","24","3","","Kalaivani, P.; Prabhakaran, R.; Poornima, P.; Dallemer, F.; Vijayalakshmi, K.; Padma, V. Vijaya; Natarajan, K.","Versatile Coordination Behavior of Salicylaldehydethiosemicarbazone in Ruthenium(II) Carbonyl Complexes: Synthesis, Spectral, X-ray, Electrochemistry, DNA Binding, Cytotoxicity, and Cellular Uptake Studies","Organometallics","2012","31","23","8323","","10.1021/om300914n","","x-ray","0.71073","MoKα","","0.1734","0.0817","","","0.1961","0.2289","","","","","","1.03","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079656","9.547","0.01","11.309","0.013","20.59","0.02","79.17","0.07","76.9","0.07","77.94","0.07","2094","4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H41 F12 Fe Ge Na O7 -","- C39 H41 F12 Fe Ge Na O7 -","- C78 H82 F24 Fe2 Ge2 Na2 O14 -","2","1","","Kano, Naokazu; Yoshinari, Naohito; Shibata, Yusuke; Miyachi, Mariko; Kawashima, Takayuki; Enomoto, Masaya; Okazawa, Atsushi; Kojima, Norimichi; Guo, Jing-Dong; Nagase, Shigeru","Anionic Iron Complexes with a Bond between an Ate-Type Pentacoordinated Germanium and an Iron Atom","Organometallics","2012","31","23","8059","","10.1021/om300915y","","","0.7107","MoKα","","0.0821","0.0516","","","0.1121","0.1447","","","","","","1.039","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079657","9.703","0.002","18.313","0.005","20.76","0.005","90","","93.267","0.003","90","","3682.9","1.5","113","2","113","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H33 F12 Fe Ge N O4 -","- C37 H33 F12 Fe Ge N O4 -","- C148 H132 F48 Fe4 Ge4 N4 O16 -","4","1","","Kano, Naokazu; Yoshinari, Naohito; Shibata, Yusuke; Miyachi, Mariko; Kawashima, Takayuki; Enomoto, Masaya; Okazawa, Atsushi; Kojima, Norimichi; Guo, Jing-Dong; Nagase, Shigeru","Anionic Iron Complexes with a Bond between an Ate-Type Pentacoordinated Germanium and an Iron Atom","Organometallics","2012","31","23","8059","","10.1021/om300915y","","","0.7107","MoKα","","0.065","0.0555","","","0.1391","0.1463","","","","","","1.084","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079658","16.1135","0.0006","16.1135","0.0006","42.1276","0.0011","90","","90","","90","","10938.2","0.6","180","2","180.15","","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C27 H36 Au Cl N2 O2 -","- C27 H36 Au Cl N2 O2 -","- C432 H576 Au16 Cl16 N32 O32 -","16","2","","Banerjee, Dipshikha; Buzas, Andrea K.; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Gold Complexes: Synthesis, Properties, and Application in Asymmetric Catalysis","Organometallics","2012","31","23","8348","","10.1021/om300917m","","","1.5418","CuKα","","0.0548","0.0486","","","0.1192","0.1294","","","","","","1.059","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079659","15.9701","0.0005","10.82036","0.00017","20.1894","0.0006","90","","119.534","0.004","90","","3035.45","0.18","180","2","180","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C33.25 H36.5 Au Cl1.5 N2 -","- C33.25 H36.5 Au Cl1.5 N2 -","- C133 H146 Au4 Cl6 N8 -","4","1","","Banerjee, Dipshikha; Buzas, Andrea K.; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Gold Complexes: Synthesis, Properties, and Application in Asymmetric Catalysis","Organometallics","2012","31","23","8348","","10.1021/om300917m","","","0.7107","MoKα","","0.0332","0.0271","","","0.0585","0.0615","","","","","","1.057","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079660","16.8311","0.0002","11.27375","0.00019","9.36012","0.00012","90","","100.029","0.0013","90","","1748.94","0.04","180.6","","180.6","","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C29 H38 Au F6 N3 O6 S2 -","- C29 H38 Au F6 N3 O6 S2 -","- C58 H76 Au2 F12 N6 O12 S4 -","2","0.5","","Banerjee, Dipshikha; Buzas, Andrea K.; Besnard, Céline; Kündig, E. Peter","Chiral N-Heterocyclic Carbene Gold Complexes: Synthesis, Properties, and Application in Asymmetric Catalysis","Organometallics","2012","31","23","8348","","10.1021/om300917m","","","1.5418","CuKα","","0.0252","0.0251","","","0.0663","0.0663","","","","","","1.052","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079661","8.0009","0.001","15.3847","0.0019","12.2845","0.0015","90","","92.387","0.002","90","","1510.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 N2 S Zn -","- C14 H24 N2 S Zn -","- C56 H96 N8 S4 Zn4 -","4","1","","Kozhukh, Julia; Fedoce Lopes, Juliana; Dos Santos, Hélio F.; Lippard, Stephen J.","Reactions of Organozinc Thiolates with Nitrosonium Ion:C-Nitroso Formation by Possible Transnitrosation","Organometallics","2012","31","23","8063","","10.1021/om300922m","","","0.71073","MoKα","","0.0597","0.0367","","","0.0669","0.075","","","","","","1.044","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079662","16.1505","0.0011","8.1973","0.0006","30.792","0.002","90","","93.191","0.001","90","","4070.2","0.5","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 N2 S Zn -","- C21 H30 N2 S Zn -","- C168 H240 N16 S8 Zn8 -","8","2","","Kozhukh, Julia; Fedoce Lopes, Juliana; Dos Santos, Hélio F.; Lippard, Stephen J.","Reactions of Organozinc Thiolates with Nitrosonium Ion:C-Nitroso Formation by Possible Transnitrosation","Organometallics","2012","31","23","8063","","10.1021/om300922m","","","0.71073","MoKα","","0.0346","0.0272","","","0.0652","0.07","","","","","","1.043","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079663","8.7539","0.0007","10.3947","0.0008","17.2466","0.0014","90","","90","","90","","1569.3","0.2","110","2","110","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H22 N2 O2 -","- C18 H22 N2 O2 -","- C72 H88 N8 O8 -","4","0.5","","Kozhukh, Julia; Fedoce Lopes, Juliana; Dos Santos, Hélio F.; Lippard, Stephen J.","Reactions of Organozinc Thiolates with Nitrosonium Ion:C-Nitroso Formation by Possible Transnitrosation","Organometallics","2012","31","23","8063","","10.1021/om300922m","","","0.71073","MoKα","","0.0435","0.0387","","","0.1089","0.1124","","","","","","1.052","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079664","7.8763","0.0001","12.4621","0.0002","46.7798","0.0007","90","","90","","90","","4591.68","0.12","120","2","120","2","","","","","","","synthesis","7","P 21 21 21","P 2ac 2ab","19","","","","- C19 H27.5 Cu F6 N O2.25 P -","- C19 H27 Cu F6 N O2.2585 P -","- C152 H216 Cu8 F48 N8 O18.068 P8 -","8","2","","López, Luis A.; Barrio, Pablo; Borge, Javier","Cationic Copper(I) Carbene Complexes: Synthesis and Structures of a Tricoordinate Copper(I) Carbene Water Complex and a Dicoordinate Carbene Complex","Organometallics","2012","31","22","7844","","10.1021/om300925w","","","1.54184","CuKα","","0.0834","0.0448","","","0.0929","0.1074","","","","","","0.73","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079665","9.5814","0.0008","10.8494","0.0008","12.35","0.0008","101.232","0.006","92.962","0.006","110.184","0.006","1172","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H31 P Ti -","- C29 H31 P Ti -","- C58 H62 P2 Ti2 -","2","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","0.71073","MoKα","","0.0816","0.0383","","","0.0483","0.051","","","","","","0.864","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079666","8.6945","0.0002","16.3391","0.0004","13.1992","0.0002","90","","99.481","0.002","90","","1849.47","0.07","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H25 P Ti -","- C23 H25 P Ti -","- C92 H100 P4 Ti4 -","4","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.0292","0.0272","","","0.0728","0.0746","","","","","","1.034","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079667","11.1956","0.001","11.2091","0.0008","11.5927","0.001","102.585","0.006","99.292","0.008","116.434","0.008","1214.5","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H38 P Ti -","- C29 H38 P Ti -","- C58 H76 P2 Ti2 -","2","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.0405","0.0339","","","0.088","0.0909","","","","","","1.017","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079668","8.8646","0.0002","11.268","0.0002","20.0673","0.0004","90","","90","","90","","2004.45","0.07","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H26 Cl P Ti -","- C23 H26 Cl P Ti -","- C92 H104 Cl4 P4 Ti4 -","4","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.0409","0.0399","","","0.1081","0.1089","","","","","","1.047","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079669","14.2913","0.0002","11.3559","0.0002","10.8545","0.0002","90","","98.416","0.002","90","","1742.61","0.05","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 Si Ti -","- C19 H26 Si Ti -","- C76 H104 Si4 Ti4 -","4","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.0263","0.0259","","","0.0735","0.0739","","","","","","1.044","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079670","17.731","0.0008","9.0707","0.0004","20.6103","0.001","90","","111.788","0.006","90","","3078","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H31 Mo O5 P Ti -","- C34 H31 Mo O5 P Ti -","- C136 H124 Mo4 O20 P4 Ti4 -","4","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","0.71073","MoKα","","0.0503","0.0281","","","0.0306","0.0315","","","","","","0.877","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079671","9.8908","0.0008","10.7751","0.0008","14.1037","0.001","71.701","0.006","73.907","0.006","65.681","0.008","1281.31","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H31 Au Cl P Ti -","- C29 H31 Au Cl P Ti -","- C58 H62 Au2 Cl2 P2 Ti2 -","2","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","0.71073","MoKα","","0.0304","0.022","","","0.0289","0.0293","","","","","","0.855","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079672","16.4511","0.0004","9.0162","0.0002","24.5164","0.0006","90","","91.091","0.002","90","","3635.77","0.15","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Ti -","- C23 H26 Ti -","- C184 H208 Ti8 -","8","2","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.0522","0.0335","","","0.0751","0.0801","","","","","","0.953","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079673","11.1827","0.0002","14.1389","0.0002","14.6759","0.0004","90","","90","","90","","2320.42","0.08","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C29 H32 Ti2 -","- C29 H32 Ti2 -","- C116 H128 Ti8 -","4","1","","Tagne Kuate, Alain C.; Mohapatra, Swagat K.; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Mono- and Dilithiation of [(η7-C7H7)Ti(η5-C5Me5)] (Pentamethyltroticene) for the Synthesis of Troticenyl Monophosphanes and [2]Troticenophanes with C‒P and C‒Si Bridges","Organometallics","2012","31","24","8544","","10.1021/om300927r","","","1.54184","CuKα","","0.022","0.0215","","","0.0576","0.0578","","","","","","1.059","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079674","13.1828","0.0007","7.6142","0.0004","13.2748","0.0007","90","","107.163","0.002","90","","1273.14","0.12","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H18 Br N -","- C13 H18 Br N -","- C52 H72 Br4 N4 -","4","2","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0209","0.0201","","","0.049","0.0493","","","","","","1.071","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079675","8.8614","0.0007","8.8975","0.0007","11.555","0.0008","106.489","0.002","90.801","0.002","102.59","0.002","849.77","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H22 F3 N O3 S -","- C16 H22 F3 N O3 S -","- C32 H44 F6 N2 O6 S2 -","2","1","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0538","0.0458","","","0.1084","0.1129","","","","","","1.037","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079676","18.0459","0.0009","8.6262","0.0004","24.7215","0.0012","90","","92.086","0.002","90","","3845.8","0.3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 F3 N O3 S Si -","- C16 H24 F3 N O3 S Si -","- C128 H192 F24 N8 O24 S8 Si8 -","8","1","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0581","0.049","","","0.1099","0.1147","","","","","","1.133","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079677","12.6524","0.0006","9.421","0.0005","18.1857","0.0009","90","","90.093","0.002","90","","2167.7","0.19","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 Cl3 N Si -","- C18 H30 Cl3 N Si -","- C72 H120 Cl12 N4 Si4 -","4","1","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0365","0.0312","","","0.0824","0.0849","","","","","","1.039","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079678","9.7698","0.0008","10.8203","0.0009","12.2565","0.0011","110.776","0.002","91.712","0.002","98.572","0.002","1193.07","0.18","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H26 F3 N O3 S -","- C26 H26 F3 N O3 S -","- C52 H52 F6 N2 O6 S2 -","2","1","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0841","0.0642","","","0.1267","0.135","","","","","","1.093","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079679","6.2731","0.0003","7.8393","0.0004","27.5628","0.0015","90","","90","","90","","1355.45","0.12","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H18 Br N O -","- C13 H18 Br N O -","- C52 H72 Br4 N4 O4 -","4","1","","García-López, José-Antonio; Saura-Llamas, Isabel; McGrady, John E.; Bautista, Delia; Vicente, José","Insertion of Allenes into the Pd–C Bond of Ortho-Palladated Primary Arylamines of Biological Relevance: Phenethylamine, Phentermine, (l)-Phenylalanine Methyl Ester, and (l)-Tryptophan Methyl Ester. Synthesis of Tetrahydro-3-benzazepines and Their Salts","Organometallics","2012","31","23","8333","","10.1021/om300928j","","","0.71073","MoKα","","0.0357","0.0317","","","0.0682","0.0698","","","","","","1.053","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079680","18.1595","0.0002","16.0778","0.0001","21.4623","0.0002","90","","108.734","0.001","90","","5934.25","0.1","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C53 H38 Cl2 N8 O20 Ru6 -","- C53 H38 Cl2 N8 O20 Ru6 -","- C212 H152 Cl8 N32 O80 Ru24 -","4","1","","Cabeza, Javier A.; Damonte, Marina; Pérez-Carreño, Enrique","Reactivity of a Bis(N-heterocyclic carbene) with Ruthenium Carbonyl. Synthesis of Mono- and Trinuclear Derivatives and Ligand Modification via C‒H Bond Activation","Organometallics","2012","31","23","8355","","10.1021/om3009298","","","1.5418","CuKα","","0.0395","0.0274","","","0.0586","0.0631","","","","","","0.974","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079681","13.7947","0.0003","8.3567","0.0002","22.6665","0.0005","90","","97.733","0.002","90","","2589.19","0.1","123","0.1","123","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 N4 O8 Ru3 -","- C24 H18 N4 O8 Ru3 -","- C96 H72 N16 O32 Ru12 -","4","1","","Cabeza, Javier A.; Damonte, Marina; Pérez-Carreño, Enrique","Reactivity of a Bis(N-heterocyclic carbene) with Ruthenium Carbonyl. Synthesis of Mono- and Trinuclear Derivatives and Ligand Modification via C‒H Bond Activation","Organometallics","2012","31","23","8355","","10.1021/om3009298","","","1.5418","CuKα","","0.036","0.0282","","","0.0697","0.0742","","","","","","1.003","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079682","17.0108","0.0017","19.7941","0.0019","16.8614","0.0017","90","","90","","90","","5677.5","1","90","2","90","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C68 H82 Cr2 -","- C68 H82 Cr2 -","- C272 H328 Cr8 -","4","1","","Boynton, Jessica N.; Summerscales, Owen T.; Grandjean, Fernande; Long, Gary J.; Fettinger, James C.; Power, Philip P.","Structural and Magnetic Studies of a Quasi-Inverse Sandwich Cyclooctatetraene Complex with Two High-Spin Chromium(II) Ions Bound Anti-Facially","Organometallics","2012","31","24","8556","","10.1021/om300936s","","","0.71073","MoKα","","0.0337","0.0297","","","0.0724","0.0739","","","","","","1.028","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079683","7.5788","0.0005","8.8191","0.0006","14.7063","0.0009","88.938","0.004","80.939","0.004","64.881","0.004","877.59","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H Cl3 Fe2 O6 S2 -","- C12 H Cl3 Fe2 O6 S2 -","- C24 H2 Cl6 Fe4 O12 S4 -","2","1","","Donovan, Elizabeth S.; McCormick, Joseph J.; Nichol, Gary S.; Felton, Greg A. N.","Cyclic Voltammetric Studies of Chlorine-Substituted Diiron Benzenedithiolato Hexacarbonyl Electrocatalysts Inspired by the [FeFe]-Hydrogenase Active Site","Organometallics","2012","31","23","8067","","10.1021/om300938e","","","0.71073","MoKα","","0.0506","0.0363","","","0.0918","0.099","","","","","","1.046","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079684","7.6077","0.0005","8.8047","0.0006","14.9168","0.0006","82.808","0.004","80.371","0.004","65.763","0.006","896.49","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 Cl4 Fe2 O6 S2 -","- C12 Cl4 Fe2 O6 S2 -","- C24 Cl8 Fe4 O12 S4 -","2","1","","Donovan, Elizabeth S.; McCormick, Joseph J.; Nichol, Gary S.; Felton, Greg A. N.","Cyclic Voltammetric Studies of Chlorine-Substituted Diiron Benzenedithiolato Hexacarbonyl Electrocatalysts Inspired by the [FeFe]-Hydrogenase Active Site","Organometallics","2012","31","23","8067","","10.1021/om300938e","","","0.71073","MoKα","","0.0368","0.0289","","","0.0539","0.058","","","","","","1.041","","","","has coordinates","204142","2020-10-21","18:00:00",""
"4079685","9.572","0.001","17.2005","0.0018","26.67","0.003","103.345","0.007","93.393","0.008","95.516","0.008","4237.6","0.8","260","2","260","2","","","","","","","","5","P -1","-P 1","2","","","","- C82.5 H104 Br4 N12 Zr2 -","- C82.5 H104 Br4 N12 Zr2 -","- C165 H208 Br8 N24 Zr4 -","2","1","","Fernández-Galán, Rafael; Antiñolo, Antonio; Carrillo-Hermosilla, Fernando; López-Solera, Isabel; Otero, Antonio; Serrano-Laguna, Amparo; Villaseñor, Elena","Migratory Insertion Reactions in Asymmetrical Guanidinate-Supported Zirconium Complexes","Organometallics","2012","31","23","8360","","10.1021/om300942p","","","0.71073","MoKα","","0.2367","0.0747","","","0.1744","0.2627","","","","","","0.848","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079686","14.4783","0.001","12.1346","0.0009","15.9903","0.0016","90","","116.397","0.003","90","","2516.4","0.4","260","2","260","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H40 Cl2 N6 Zr -","- C18 H40 Cl2 N6 Zr -","- C72 H160 Cl8 N24 Zr4 -","4","1","","Fernández-Galán, Rafael; Antiñolo, Antonio; Carrillo-Hermosilla, Fernando; López-Solera, Isabel; Otero, Antonio; Serrano-Laguna, Amparo; Villaseñor, Elena","Migratory Insertion Reactions in Asymmetrical Guanidinate-Supported Zirconium Complexes","Organometallics","2012","31","23","8360","","10.1021/om300942p","","","0.71073","MoKα","","0.1362","0.0629","","","0.1379","0.1734","","","","","","0.963","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079687","11.8113","0.0007","16.1538","0.0008","16.9957","0.0011","72.863","0.003","79.891","0.003","75.84","0.003","2985.8","0.3","260","2","260","2","","","","","","","","4","P -1","-P 1","2","","","","- C64 H88 N8 Zr -","- C64 H88 N8 Zr -","- C128 H176 N16 Zr2 -","2","1","","Fernández-Galán, Rafael; Antiñolo, Antonio; Carrillo-Hermosilla, Fernando; López-Solera, Isabel; Otero, Antonio; Serrano-Laguna, Amparo; Villaseñor, Elena","Migratory Insertion Reactions in Asymmetrical Guanidinate-Supported Zirconium Complexes","Organometallics","2012","31","23","8360","","10.1021/om300942p","","","0.71073","MoKα","","0.1161","0.0598","","","0.1383","0.1663","","","","","","0.988","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079688","11.241","0.002","13.366","0.003","18.174","0.004","93.24","0.03","104.97","0.03","109.65","0.03","2453.3","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H51 N3 Si Zr -","- C54 H51 N3 Si Zr -","- C108 H102 N6 Si2 Zr2 -","2","1","","Zhao, Jing; Zhang, Shaoguang; Zhang, Wen-Xiong; Xi, Zhenfeng","Reactivity of Seven-Membered Azazirconacycloallenes and Four-Membered Zirconacycles toward Diphenylacetonitrile","Organometallics","2012","31","23","8370","","10.1021/om300949a","","","0.71073","MoKα","","0.1885","0.0629","","","0.086","0.0937","","","","","","0.997","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079689","36.131","0.007","10.712","0.002","19.949","0.004","90","","100","0.03","90","","7604","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H41 Br N2 Si Zr -","- C40 H41 Br N2 Si Zr -","- C320 H328 Br8 N16 Si8 Zr8 -","8","1","","Zhao, Jing; Zhang, Shaoguang; Zhang, Wen-Xiong; Xi, Zhenfeng","Reactivity of Seven-Membered Azazirconacycloallenes and Four-Membered Zirconacycles toward Diphenylacetonitrile","Organometallics","2012","31","23","8370","","10.1021/om300949a","","","0.71073","MoKα","","0.0729","0.0601","","","0.1187","0.1258","","","","","","1.097","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079690","36.3","0.007","10.477","0.002","20.048","0.004","90","","101.69","0.03","90","","7466","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H41 Cl N2 Si Zr -","- C40 H41 Cl N2 Si Zr -","- C320 H328 Cl8 N16 Si8 Zr8 -","8","1","","Zhao, Jing; Zhang, Shaoguang; Zhang, Wen-Xiong; Xi, Zhenfeng","Reactivity of Seven-Membered Azazirconacycloallenes and Four-Membered Zirconacycles toward Diphenylacetonitrile","Organometallics","2012","31","23","8370","","10.1021/om300949a","","","0.71073","MoKα","","0.138","0.0994","","","0.1448","0.1607","","","","","","1.154","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079691","28.747","0.004","14.691","0.002","22.158","0.003","90","","102.019","0.002","90","","9153","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H48 N2 Si Zr -","- C56 H48 N2 Si Zr -","- C448 H384 N16 Si8 Zr8 -","8","1","","Zhao, Jing; Zhang, Shaoguang; Zhang, Wen-Xiong; Xi, Zhenfeng","Reactivity of Seven-Membered Azazirconacycloallenes and Four-Membered Zirconacycles toward Diphenylacetonitrile","Organometallics","2012","31","23","8370","","10.1021/om300949a","","","0.71073","MoKα","","0.071","0.0355","","","0.0564","0.0608","","","","","","1.02","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079692","13.325","0.0019","9.454","0.0013","14.545","0.002","90","","92.884","0.004","90","","1830","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 O2 Ti -","- C24 H22 O2 Ti -","- C96 H88 O8 Ti4 -","4","1","","Desnoyer, Addison N.; Fartel, Beata; MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Ambient-Temperature Carbon‒Oxygen Bond Cleavage of an α-Aryloxy Ketone with Cp2Ti(BTMSA) and Selective Protonolysis of the Resulting Ti‒OR Bonds","Organometallics","2012","31","21","7625","","10.1021/om300950c","","","0.71073","MoKα","","0.0803","0.0465","","","0.1061","0.1209","","","","","","1.022","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079693","9.132","0.0011","13.5283","0.0016","16.404","0.003","88.597","0.003","83.995","0.003","85.32","0.003","2008.5","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H23 Cl O2 Ti -","- C24 H23 Cl O2 Ti -","- C96 H92 Cl4 O8 Ti4 -","4","2","","Desnoyer, Addison N.; Fartel, Beata; MacLeod, K. Cory; Patrick, Brian O.; Smith, Kevin M.","Ambient-Temperature Carbon‒Oxygen Bond Cleavage of an α-Aryloxy Ketone with Cp2Ti(BTMSA) and Selective Protonolysis of the Resulting Ti‒OR Bonds","Organometallics","2012","31","21","7625","","10.1021/om300950c","","","0.71073","MoKα","","0.0402","0.0303","","","0.0733","0.0794","","","","","","1.047","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079694","8.738","0.0006","9.139","0.0007","17.4282","0.0012","97.261","0.004","103.816","0.003","96.412","0.003","1326.03","0.17","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C30 H28 Cl2 Zr -","- C30 H28 Cl2 Zr -","- C60 H56 Cl4 Zr2 -","2","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.069","0.0591","","","0.1216","0.1259","","","","","","1.145","","","","has coordinates,has disorder","178685","2020-10-21","18:00:00",""
"4079695","11.8432","0.0007","16.4959","0.0012","17.1659","0.0012","90","","92.766","0.004","90","","3349.7","0.4","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H46 Cl2 Zr -","- C39 H46 Cl2 Zr -","- C156 H184 Cl8 Zr4 -","4","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.0379","0.0307","","","0.0832","0.1004","","","","","","1.132","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079696","10.9477","0.0004","11.8652","0.0003","15.2718","0.0005","77","0.001","75.093","0.002","78.461","0.001","1846.45","0.1","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C43 H46 Cl2 Zr -","- C43 H46 Cl2 Zr -","- C86 H92 Cl4 Zr2 -","2","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.0456","0.0359","","","0.0703","0.0743","","","","","","1.029","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079697","11.551","0.007","24.178","0.016","28.816","0.018","90","","90","","90","","8048","9","100","2","100","2","","","","","","","synthesis as described","4","P b c a","-P 2ac 2ab","61","","","","- C44 H58 Cl2 Zr -","- C44 H58 Cl2 Zr -","- C352 H464 Cl16 Zr8 -","8","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.1458","0.103","","","0.176","0.1937","","","","","","1.219","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079698","11.8504","0.0012","13.2311","0.0016","25.354","0.002","93.974","0.004","92.762","0.004","96.535","0.004","3933.7","0.7","150","2","150","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C46 H56 Cl2 Zr -","- C46 H56 Cl2 Zr -","- C184 H224 Cl8 Zr4 -","4","2","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.1767","0.1245","","","0.3068","0.3491","","","","","","1.043","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079699","9.8463","0.0008","14.0657","0.0012","29.101","0.003","90","","91.551","0.004","90","","4028.9","0.6","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C47 H56 Cl2 Zr -","- C47 H56 Cl2 Zr -","- C188 H224 Cl8 Zr4 -","4","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.0858","0.0737","","","0.1541","0.1606","","","","","","1.116","","","","has coordinates","178685","2020-10-21","18:00:00",""
"4079700","8.9402","0.0008","12.2725","0.0014","13.4389","0.0015","117.094","0.006","91.79","0.006","90.006","0.006","1311.9","0.3","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C30 H36 Cl2 Zr -","- C30 H36 Cl2 Zr -","- C60 H72 Cl4 Zr2 -","2","1","","Bader, Manuela; Marquet, Nicolas; Kirillov, Evgeny; Roisnel, Thierry; Razavi, Abbas; Lhost, Olivier; Carpentier, Jean-François","Old and NewC1-Symmetric Group 4 Metallocenes {(R1R2C)-(R2′R3′R6′R7′-Flu)(3-R3-5-R4-C5H2)}ZrCl2: From Highly Isotactic Polypropylenes to Vinyl End-Capped Isotactic-Enriched Oligomers","Organometallics","2012","31","23","8375","","10.1021/om300957k","","x-ray","0.71073","MoKα","","0.0567","0.0368","","","0.0733","0.0806","","","","","","1.016","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079701","11.887","0.003","14.052","0.003","14.801","0.003","78.24","0.012","78.94","0.01","84.63","0.013","2371.6","0.9","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H42 F12 N12 P2 Ru -","- C42 H42 F12 N12 P2 Ru -","- C84 H84 F24 N24 P4 Ru2 -","2","1","","Yang, Wen-Wen; Yao, Jiannian; Zhong, Yu-Wu","Redox-Asymmetric Bisruthenium Complex Bridged by a Pyridin-4-yl Moiety: Synthesis, Characterization, and Electronic Coupling Studies","Organometallics","2012","31","24","8577","","10.1021/om3009662","","","0.71073","MoKα","","0.1623","0.1199","","","0.3025","0.3381","","","","","","1.073","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079702","12.1796","0.0011","15.548","0.0009","21.1054","0.0019","90","","117.902","0.006","90","","3532.1","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 O9 P2 Pd S2 -","- C34 H32 O9 P2 Pd S2 -","- C136 H128 O36 P8 Pd4 S8 -","4","1","","R Thomas; Tritschler, Ulrich; Roesle, Philipp; Göttker-Schnetmann, Inigo; Müller, Heiko M.; Caporaso, Lucia; Poater, Albert; Cavallo, Luigi; Mecking, Stefan","Activation and Deactivation of Neutral Palladium(II) Phosphinesulfonato Polymerization Catalysts","Organometallics","2012","31","23","8388","","10.1021/om300969d","","","0.71073","MoKα","","0.0607","0.0471","","","0.1099","0.1136","","","","","","1.115","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079703","25.0992","0.0016","11.8473","0.0005","21.5097","0.0014","90","","99.928","0.005","90","","6300.3","0.6","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H44 Cl16 O10 P2 Pd S2 -","- C48 H44 Cl16 O10 P2 Pd S2 -","- C192 H176 Cl64 O40 P8 Pd4 S8 -","4","0.5","","R Thomas; Tritschler, Ulrich; Roesle, Philipp; Göttker-Schnetmann, Inigo; Müller, Heiko M.; Caporaso, Lucia; Poater, Albert; Cavallo, Luigi; Mecking, Stefan","Activation and Deactivation of Neutral Palladium(II) Phosphinesulfonato Polymerization Catalysts","Organometallics","2012","31","23","8388","","10.1021/om300969d","","","0.71073","MoKα","","0.0521","0.0401","","","0.1101","0.1132","","","","","","0.968","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079704","18.1536","0.0014","11.6821","0.0006","34.931","0.003","90","","99.484","0.006","90","","7306.6","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H36 O9 P2 Pd S2 -","- C35.984 H35.968 O9 P2 Pd S2 -","- C287.872 H287.744 O72 P16 Pd8 S16 -","8","1","","R Thomas; Tritschler, Ulrich; Roesle, Philipp; Göttker-Schnetmann, Inigo; Müller, Heiko M.; Caporaso, Lucia; Poater, Albert; Cavallo, Luigi; Mecking, Stefan","Activation and Deactivation of Neutral Palladium(II) Phosphinesulfonato Polymerization Catalysts","Organometallics","2012","31","23","8388","","10.1021/om300969d","","","0.71073","MoKα","","0.1543","0.0571","","","0.0802","0.102","","","","","","0.878","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079705","9.5966","0.0008","12.0664","0.001","15.6496","0.0014","92.336","0.007","100.896","0.007","96.725","0.007","1763.6","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H49 O5 P2 Pd S -","- C35 H49 O5 P2 Pd S -","- C70 H98 O10 P4 Pd2 S2 -","2","1","","R Thomas; Tritschler, Ulrich; Roesle, Philipp; Göttker-Schnetmann, Inigo; Müller, Heiko M.; Caporaso, Lucia; Poater, Albert; Cavallo, Luigi; Mecking, Stefan","Activation and Deactivation of Neutral Palladium(II) Phosphinesulfonato Polymerization Catalysts","Organometallics","2012","31","23","8388","","10.1021/om300969d","","","0.71073","MoKα","","0.0392","0.0313","","","0.0769","0.0836","","","","","","1.112","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079706","13.1277","0.0002","13.6566","0.0003","15.6227","0.0003","90","","106.332","0.001","90","","2687.82","0.09","103","2","103","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30.25 H29.5 Cl1.5 N P Pt -","- C30.252 H29.504 Cl1.504 N P Pt -","- C121.008 H118.016 Cl6.016 N4 P4 Pt4 -","4","2","","Tan, Kien-Wee; Yang, Xiang-Yuan; Li, Yongxin; Huang, Yinhua; Pullarkat, Sumod A.; Leung, Pak-Hing","Reactivity of Cycloplatinated Amine Complexes: Intramolecular C‒C Bond Formation, C‒H Activation, and PPh2Migration in Coordinated Alkynylphosphines","Organometallics","2012","31","23","8407","","10.1021/om300976y","","","0.71073","MoKα","","0.0327","0.0257","","","0.0651","0.0909","","","","","","1.128","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079707","9.5284","0.0003","10.4146","0.0004","14.4364","0.0005","81.314","0.001","74.581","0.001","66.956","0.001","1269.05","0.08","103","2","103","2","","","","","","","","6","P 1","P 1","1","","","","- C30 H29 Cl N P Pt -","- C30 H29 Cl N P Pt -","- C60 H58 Cl2 N2 P2 Pt2 -","2","2","","Tan, Kien-Wee; Yang, Xiang-Yuan; Li, Yongxin; Huang, Yinhua; Pullarkat, Sumod A.; Leung, Pak-Hing","Reactivity of Cycloplatinated Amine Complexes: Intramolecular C‒C Bond Formation, C‒H Activation, and PPh2Migration in Coordinated Alkynylphosphines","Organometallics","2012","31","23","8407","","10.1021/om300976y","","","0.71073","MoKα","","0.0352","0.0286","","","0.062","0.0857","","","","","","1.097","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079708","7.8961","0.0001","23.6603","0.0005","11.7411","0.0002","90","","94.654","0.002","90","","2186.29","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H26 Cl N3 Ru -","- C25 H26 Cl N3 Ru -","- C100 H104 Cl4 N12 Ru4 -","4","1","","Donnelly, Kate F.; Lalrempuia, Ralte; Müller-Bunz, Helge; Albrecht, Martin","Regioselective Electrophilic C‒H Bond Activation in Triazolylidene Metal Complexes Containing a N-Bound Phenyl Substituent","Organometallics","2012","31","23","8414","","10.1021/om300983m","","","1.54184","CuKα","","0.0192","0.019","","","0.0489","0.049","","","","","","1.068","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079709","14.2329","0.0002","11.8731","0.0001","13.7233","0.0002","90","","93.932","0.001","90","","2313.62","0.05","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Cl0.878 I0.122 Ir N3 -","- C25 H27 Cl0.8776 I0.1224 Ir N3 -","- C100 H108 Cl3.5104 I0.4896 Ir4 N12 -","4","1","","Donnelly, Kate F.; Lalrempuia, Ralte; Müller-Bunz, Helge; Albrecht, Martin","Regioselective Electrophilic C‒H Bond Activation in Triazolylidene Metal Complexes Containing a N-Bound Phenyl Substituent","Organometallics","2012","31","23","8414","","10.1021/om300983m","","","0.71073","MoKα","","0.0257","0.0191","","","0.041","0.0437","","","","","","1.059","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079710","13.9629","0.0001","14.5367","0.0001","26.3152","0.0002","90","","97.6443","0.0008","90","","5293.85","0.07","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C47 H51 Cl5 F12 N6 P2 Pt2 -","- C47 H51 Cl5 F12 N6 P2 Pt2 -","- C188 H204 Cl20 F48 N24 P8 Pt8 -","4","0.5","","Donnelly, Kate F.; Lalrempuia, Ralte; Müller-Bunz, Helge; Albrecht, Martin","Regioselective Electrophilic C–H Bond Activation in Triazolylidene Metal Complexes Containing a N-Bound Phenyl Substituent","Organometallics","2012","31","23","8414","","10.1021/om300983m","","","0.71073","MoKα","","0.0592","0.0564","","","0.1185","0.1195","","","","","","1.389","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079711","7.6878","0.00013","9.0852","0.0002","15.2939","0.0004","104.585","0.002","93.0047","0.0017","100.758","0.0016","1010.05","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H25 Cl N3 Rh -","- C23 H25 Cl N3 Rh -","- C46 H50 Cl2 N6 Rh2 -","2","1","","Donnelly, Kate F.; Lalrempuia, Ralte; Müller-Bunz, Helge; Albrecht, Martin","Regioselective Electrophilic C‒H Bond Activation in Triazolylidene Metal Complexes Containing a N-Bound Phenyl Substituent","Organometallics","2012","31","23","8414","","10.1021/om300983m","","","0.71073","MoKα","","0.0242","0.0215","","","0.0483","0.0496","","","","","","1.059","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079712","12.259","0.0001","18.413","0.0001","18.183","0.0002","90","","99.087","0.001","90","","4052.85","0.06","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H51 N2 P2 Rh -","- C46 H51 N2 P2 Rh -","- C184 H204 N8 P8 Rh4 -","4","1","","Segarra, Candela; Mas-Marz Elena; Lowe, John P.; Mahon, Mary F.; Poulten, Rebecca C.; Whittlesey, Michael K.","Ring-Expanded N-Heterocyclic Carbene Complexes of Rhodium with Bifluoride, Fluoride, and Fluoroaryl Ligands","Organometallics","2012","31","24","8584","","10.1021/om300984v","","","0.71073","MoKα","","0.0353","0.0274","","","0.0631","0.0684","","","","","","0.994","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079713","10.7914","0.0003","11.689","0.0003","18.7289","0.0004","75.783","0.002","86.843","0.002","70.878","0.002","2162.93","0.1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H58 F2 N2 P2 Rh -","- C49 H58 F2 N2 P2 Rh -","- C98 H116 F4 N4 P4 Rh2 -","2","1","","Segarra, Candela; Mas-Marz Elena; Lowe, John P.; Mahon, Mary F.; Poulten, Rebecca C.; Whittlesey, Michael K.","Ring-Expanded N-Heterocyclic Carbene Complexes of Rhodium with Bifluoride, Fluoride, and Fluoroaryl Ligands","Organometallics","2012","31","24","8584","","10.1021/om300984v","","","0.7107","MoKα","","0.0531","0.0333","","","0.0699","0.0727","","","","","","0.935","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079714","10.741","0.0002","11.606","0.0002","18.813","0.0003","74.523","0.001","88.812","0.001","69.969","0.001","2116.98","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H53 F N2 P2 Rh -","- C49 H53 F N2 P2 Rh -","- C98 H106 F2 N4 P4 Rh2 -","2","1","","Segarra, Candela; Mas-Marz Elena; Lowe, John P.; Mahon, Mary F.; Poulten, Rebecca C.; Whittlesey, Michael K.","Ring-Expanded N-Heterocyclic Carbene Complexes of Rhodium with Bifluoride, Fluoride, and Fluoroaryl Ligands","Organometallics","2012","31","24","8584","","10.1021/om300984v","","","0.71073","MoKα","","0.0592","0.0398","","","0.0861","0.0938","","","","","","1.051","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079715","10.498","0.0001","20.74","0.0003","23.255","0.0004","90","","99.073","0.001","90","","4999.93","0.12","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H56 F5 N2 P2 Rh -","- C58 H56 F5 N2 P2 Rh -","- C232 H224 F20 N8 P8 Rh4 -","4","1","","Segarra, Candela; Mas-Marz Elena; Lowe, John P.; Mahon, Mary F.; Poulten, Rebecca C.; Whittlesey, Michael K.","Ring-Expanded N-Heterocyclic Carbene Complexes of Rhodium with Bifluoride, Fluoride, and Fluoroaryl Ligands","Organometallics","2012","31","24","8584","","10.1021/om300984v","","","0.71073","MoKα","","0.0655","0.039","","","0.0804","0.0904","","","","","","1.039","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079716","38.65","0.0009","9.329","0.0003","20.091","0.0005","90","","99.36","0.002","90","","7147.7","0.3","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C41 H43.96 Br0.04 N2 O P Rh -","- C41 H43.96 Br0.04 N2 O P Rh -","- C328 H351.68 Br0.32 N16 O8 P8 Rh8 -","8","1","","Segarra, Candela; Mas-Marz Elena; Lowe, John P.; Mahon, Mary F.; Poulten, Rebecca C.; Whittlesey, Michael K.","Ring-Expanded N-Heterocyclic Carbene Complexes of Rhodium with Bifluoride, Fluoride, and Fluoroaryl Ligands","Organometallics","2012","31","24","8584","","10.1021/om300984v","","","0.71073","MoKα","","0.0723","0.0375","","","0.0824","0.0954","","","","","","1.018","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079717","10.74","0.003","17.988","0.005","18.789","0.006","92.293","0.005","92.391","0.006","90.34","0.005","3623.7","1.8","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H70.5 N8 O1.25 Ru2 S12 -","- C68 H70.5 N8 O1.25 Ru2 S12 -","- C136 H141 N16 O2.5 Ru4 S24 -","2","1","","Cai, Xu-Min; Zhang, Xiang-Yi; Savchenko, Julia; Cao, Zhi; Ren, Tong; Zuo, Jing-Lin","New Linear π-Conjugated Diruthenium Compounds Containing Axial Tetrathiafulvalene-acetylide Ligands","Organometallics","2012","31","24","8591","","10.1021/om300985z","","","0.71073","MoKα","","0.085","0.0598","","","0.1241","0.1294","","","","","","1.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079718","8.9815","0.001","7.5601","0.0008","14.071","0.0016","90","","106.058","0.009","90","","918.16","0.18","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 Br2 -","- C22 H20 Br2 -","- C44 H40 Br4 -","2","0.5","","Januszewski, Estera; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Influence of the Bridging Elements on the Optical Properties of Linked 9,10-Dihydro-9,10-diboraanthracenes","Organometallics","2012","31","23","8420","","10.1021/om300990z","","","0.71073","MoKα","","0.0496","0.0388","","","0.0773","0.0809","","","","","","1.104","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079719","21.0472","0.001","9.0583","0.0003","24.9332","0.0011","90","","104.727","0.004","90","","4597.4","0.3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 Br2 -","- C28 H24 Br2 -","- C224 H192 Br16 -","8","1","","Januszewski, Estera; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias","Influence of the Bridging Elements on the Optical Properties of Linked 9,10-Dihydro-9,10-diboraanthracenes","Organometallics","2012","31","23","8420","","10.1021/om300990z","","","0.71073","MoKα","","0.0367","0.0304","","","0.0687","0.071","","","","","","1.057","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079720","10.115","0.006","16.201","0.01","22.21","0.013","93.009","0.015","90.754","0.011","97.067","0.015","3606","4","113","2","113","2","","","","","","","","5","P -1","-P 1","2","2a","","","- C34 H52 Cl N3 Si2 -","- C34 H52 Cl N3 Si2 -","- C136 H208 Cl4 N12 Si8 -","4","2","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","0.71073","MoKα","","0.1764","0.1051","","","0.3007","0.3323","","","","","","1.089","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079721","9.011","0.005","20.22","0.011","19.411","0.011","90","","96.957","0.009","90","","3511","3","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2b","","","- C34 H52 Cl N3 Si2 -","- C34 H52 Cl N3 Si2 -","- C136 H208 Cl4 N12 Si8 -","4","1","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","0.71073","MoKα","","0.1019","0.0737","","","0.1634","0.1799","","","","","","1.171","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079722","10.483","0.003","10.8","0.004","19.839","0.006","91.576","0.004","90.342","0.005","109.762","0.007","2112.7","1.2","113","2","113","2","","","","","","","","5","P -1","-P 1","2","3","","","- C40 H56 Cl N3 Si2 -","- C40 H56 Cl N3 Si2 -","- C80 H112 Cl2 N6 Si4 -","2","1","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","0.71073","MoKα","","0.0511","0.0364","","","0.0852","0.0901","","","","","","0.983","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079723","10.588","0.002","10.827","0.002","19.271","0.005","77.452","0.01","82.016","0.011","70.643","0.009","2029.1","0.8","113","2","113","2","","","","","","","","6","P -1","-P 1","2","7a","","","- C36 H54 Cl N3 O2 Si2 -","- C36 H54 Cl N3 O2 Si2 -","- C72 H108 Cl2 N6 O4 Si4 -","2","1","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","0.71073","MoKα","","0.106","0.0627","","","0.1242","0.1432","","","","","","1.028","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079724","16.981","0.004","15.637","0.004","12.337","0.003","90","","90","","90","","3275.9","1.4","113","2","113","2","","","","","","","","6","P n a 21","P 2c -2n","33","8","","","- C30 H50 Cl N3 O2 Si2 -","- C30 H50 Cl N3 O2 Si2 -","- C120 H200 Cl4 N12 O8 Si8 -","4","1","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","1.54178","CuKα","","0.0459","0.0454","","","0.097","0.0973","","","","","","1.225","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079725","9.6398","0.0016","18.262","0.002","21.578","0.002","75.184","0.01","78.245","0.015","84.203","0.017","3590.5","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","9","","","- C33 H51 Cl N4 Si2 -","- C33 H51 Cl N4 Si2 -","- C132 H204 Cl4 N16 Si8 -","4","2","","Cui, Haiyan; Ma, Bing; Cui, Chunming","Metal-Free, Stereospecific Bis-Silylation of Functionalized Alkynes with NHC-Supported Silylaminosilylene","Organometallics","2012","31","21","7339","","10.1021/om3009958","","","1.54178","CuKα","","0.0666","0.055","","","0.1354","0.1516","","","","","","1.064","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079726","11.129","0.005","16.631","0.007","21.272","0.001","90","","98.68","0.02","90","","3892","2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H51 N5 Si -","- C46 H51 N5 Si -","- C184 H204 N20 Si4 -","4","1","","Azhakar, Ramachandran; Roesky, Herbert W.; Wolf, Hilke; Stalke, Dietmar","Reactivity of Stable Heteroleptic Silylene PhC(NtBu)2SiNPh2toward Diazobenzene andN-Benzylidineaniline","Organometallics","2012","31","24","8608","","10.1021/om300999e","","","0.71073","MoKα","","0.0655","0.0444","","","0.0959","0.1038","","","","","","1.035","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079727","11.486","0.004","15.541","0.005","19.133","0.006","90","","97.84","0.02","90","","3383.4","1.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H44 N4 Si -","- C40 H44 N4 Si -","- C160 H176 N16 Si4 -","4","1","","Azhakar, Ramachandran; Roesky, Herbert W.; Wolf, Hilke; Stalke, Dietmar","Reactivity of Stable Heteroleptic Silylene PhC(NtBu)2SiNPh2toward Diazobenzene andN-Benzylidineaniline","Organometallics","2012","31","24","8608","","10.1021/om300999e","","","0.71073","MoKα","","0.0623","0.0438","","","0.1046","0.1124","","","","","","1.056","","","","has coordinates","301830","2025-08-20","13:17:27",""
"4079728","21.374","0.0012","13.3834","0.0008","21.1553","0.0012","90","","96.549","0.004","90","","6012.1","0.6","173","2","173","2","","","","","","","synthesis as described","4","C 1 2 1","C 2y","5","[Pd2(pentalene(SiiPr3)2)2]","","","- C52 H92 Pd2 Si4 -","- C43.212 H76.452 Pd2 Si3.324 -","- C172.848 H305.808 Pd8 Si13.296 -","4","1","","Summerscales, Owen T.; Rivers, Christopher J.; Taylor, Morgan J.; Hitchcock, Peter B.; Green, Jennifer C.; Cloke, F. Geoffrey N.","Double-Sandwich Pentalene Complexes M2(pent†)2(M = Rh, Pd; pent†= 1,4-Bis(triisopropylsilyl)pentalene): Synthesis, Structure, and Bonding","Organometallics","2012","31","24","8613","","10.1021/om3010004","","x-ray","0.71073","MoKα","","0.1155","0.1087","","","0.2962","0.3021","","","","","","1.135","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079729","22.188","0.005","13.183","0.003","21.397","0.011","90","","120.37","0.03","90","","5400","4","173","2","173","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H92 Rh2 Si4 -","- C52 H92 Rh2 Si4 -","- C208 H368 Rh8 Si16 -","4","0.5","","Summerscales, Owen T.; Rivers, Christopher J.; Taylor, Morgan J.; Hitchcock, Peter B.; Green, Jennifer C.; Cloke, F. Geoffrey N.","Double-Sandwich Pentalene Complexes M2(pent†)2(M = Rh, Pd; pent†= 1,4-Bis(triisopropylsilyl)pentalene): Synthesis, Structure, and Bonding","Organometallics","2012","31","24","8613","","10.1021/om3010004","","x-ray","0.71073","MoKα","","0.0789","0.0638","","","0.1648","0.1776","","","","","","1.06","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079730","7.475","0.0006","14.0637","0.0012","15.9427","0.0013","90","","90","","90","","1676","0.2","180","2","180","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Cp*Ir(kappa2-2,4-pyridinedicarboxylic acid)Cl]","","","- C17 H19 Cl Ir N O4 -","- C17 H19 Cl Ir N O4 -","- C68 H76 Cl4 Ir4 N4 O16 -","4","1","","Bucci, Alberto; Savini, Arianna; Rocchigiani, Luca; Zuccaccia, Cristiano; Rizzato, Silvia; Albinati, Alberto; Llobet, Antoni; Macchioni, Alceo","Organometallic Iridium Catalysts Based on Pyridinecarboxylate Ligands for the Oxidative Splitting of Water","Organometallics","2012","31","23","8071","","10.1021/om301024s","","","0.71073","MoKα","","0.0187","0.0163","","","0.0351","0.0358","","","","","","1.044","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079731","16.484","0.0017","18.1198","0.0018","19.0049","0.0019","90","","90","","90","","5676.5","1","93","","93","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H35 Cl3 Mo N P2 -","- C27 H35 Cl3 Mo N P2 -","- C216 H280 Cl24 Mo8 N8 P16 -","8","1","","Kinoshita, Eriko; Arashiba, Kazuya; Kuriyama, Shogo; Miyake, Yoshihiro; Shimazaki, Ryuji; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Catalytic Activity of Molybdenum‒Dinitrogen Complexes Bearing Unsymmetric PNP-Type Pincer Ligands","Organometallics","2012","31","23","8437","","10.1021/om301046t","","","0.71075","MoKα","","","0.0301","","","","0.051","","","","","","1.038","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079732","16.1351","0.0004","18.2992","0.0004","20.8235","0.0005","90","","90","","90","","6148.3","0.3","183","","183","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H47 Cl3 Mo N P2 -","- C27 H47 Cl3 Mo N P2 -","- C216 H376 Cl24 Mo8 N8 P16 -","8","1","","Kinoshita, Eriko; Arashiba, Kazuya; Kuriyama, Shogo; Miyake, Yoshihiro; Shimazaki, Ryuji; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Catalytic Activity of Molybdenum‒Dinitrogen Complexes Bearing Unsymmetric PNP-Type Pincer Ligands","Organometallics","2012","31","23","8437","","10.1021/om301046t","","","0.71075","MoKα","","","0.0266","","","","0.0509","","","","","","1.007","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079733","19.8028","0.0004","14.0359","0.0003","26.7018","0.0005","90","","105.015","0.0007","90","","7168.4","0.3","183","","183","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C72 H88 Mo2 N12 P4 -","- C72 H70 Mo2 N12 P4 -","- C288 H280 Mo8 N48 P16 -","4","0.5","","Kinoshita, Eriko; Arashiba, Kazuya; Kuriyama, Shogo; Miyake, Yoshihiro; Shimazaki, Ryuji; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Catalytic Activity of Molybdenum‒Dinitrogen Complexes Bearing Unsymmetric PNP-Type Pincer Ligands","Organometallics","2012","31","23","8437","","10.1021/om301046t","","","0.71075","MoKα","","","0.0495","","","","0.1167","","","","","","1.02","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079734","12.4475","0.0004","22.2321","0.0007","19.5339","0.0007","90","","91.406","0.0009","90","","5404.1","0.3","198","","198","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H78 Mo2 N12 P4 -","- C42 H78 Mo2 N12 P4 -","- C168 H312 Mo8 N48 P16 -","4","1","","Kinoshita, Eriko; Arashiba, Kazuya; Kuriyama, Shogo; Miyake, Yoshihiro; Shimazaki, Ryuji; Nakanishi, Haruyuki; Nishibayashi, Yoshiaki","Synthesis and Catalytic Activity of Molybdenum‒Dinitrogen Complexes Bearing Unsymmetric PNP-Type Pincer Ligands","Organometallics","2012","31","23","8437","","10.1021/om301046t","","","0.71075","MoKα","","","0.0502","","","","0.0715","","","","","","1.011","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079735","13.9124","0.0004","15.2581","0.0004","18.9291","0.0007","90","","104.785","0.0012","90","","3885.2","0.2","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","JMM02051","JMM02051","","- C41 H28 B F20 Ir N2 -","- C41 H28 B F20 Ir N2 -","- C164 H112 B4 F80 Ir4 N8 -","4","1","","Meredith, Joseph M.; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","η6-Tetramethylfulvene and μ-η3:η3-Benzene Complexes of Iridium","Organometallics","2012","31","23","8459","","10.1021/om3010492","","","0.71073","MoKα","","0.1099","0.0457","","","0.0668","0.0802","","","","","","0.854","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079736","11.2424","0.0004","13.1663","0.0004","14.8575","0.0005","109.904","0.001","104.465","0.002","104.612","0.002","1859.81","0.12","100","2","100","2","","","","","","","","7","P -1","-P 1","2","JMM02099","JMM02099","","- C76 H62 B2 Cl4 F30 Ir2 N4 -","- C76 H62 B2 Cl4 F30 Ir2 N4 -","- C76 H62 B2 Cl4 F30 Ir2 N4 -","1","0.5","","Meredith, Joseph M.; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","η6-Tetramethylfulvene and μ-η3:η3-Benzene Complexes of Iridium","Organometallics","2012","31","23","8459","","10.1021/om3010492","","","0.71073","MoKα","","0.0144","0.0134","","","0.0351","0.0357","","","","","","1","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079737","11.9815","0.0004","12.0906","0.0004","13.5037","0.0004","108.418","0.001","101.066","0.002","102.707","0.001","1736.8","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","jmm03045","jmm03045","","- C37 H29 B F15 Ir N2 -","- C37 H29 B F15 Ir N2 -","- C74 H58 B2 F30 Ir2 N4 -","2","1","","Meredith, Joseph M.; Goldberg, Karen I.; Kaminsky, Werner; Heinekey, D. Michael","η6-Tetramethylfulvene and μ-η3:η3-Benzene Complexes of Iridium","Organometallics","2012","31","23","8459","","10.1021/om3010492","","","0.71073","MoKα","","0.0303","0.0264","","","0.0565","0.0583","","","","","","1.049","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079738","16.5362","0.0008","15.2844","0.0008","15.755","0.0008","90","","107.34","0.001","90","","3801","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35.5 H51.4 B N7 Os P -","- C35.5 H51.4 B N7 Os P -","- C142 H205.6 B4 N28 Os4 P4 -","4","1","","Bajo, Sonia; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Alkenylation of 2-Methylpyridine via Pyridylidene‒Osmium Complexes","Organometallics","2012","31","24","8618","","10.1021/om301058n","","","0.71073","MoKα","","0.039","0.0249","","","0.0626","0.0697","","","","","","1.039","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079739","16.9932","0.001","15.2993","0.0009","15.7064","0.001","90","","107.738","0.001","90","","3889.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H61 B N7 Os P -","- C37 H61 B N7 Os P -","- C148 H244 B4 N28 Os4 P4 -","4","1","","Bajo, Sonia; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Alkenylation of 2-Methylpyridine via Pyridylidene‒Osmium Complexes","Organometallics","2012","31","24","8618","","10.1021/om301058n","","","0.71073","MoKα","","0.0372","0.0262","","","0.0636","0.0675","","","","","","0.973","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079740","10.5349","0.001","20.4383","0.0018","14.8765","0.0014","90","","93.238","0.001","90","","3198","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H43 B N7 Os P -","- C32 H43 B N7 Os P -","- C128 H172 B4 N28 Os4 P4 -","4","1","","Bajo, Sonia; Esteruelas, Miguel A.; López, Ana M.; Oñate, Enrique","Alkenylation of 2-Methylpyridine via Pyridylidene‒Osmium Complexes","Organometallics","2012","31","24","8618","","10.1021/om301058n","","","0.71073","MoKα","","0.0632","0.0437","","","0.0874","0.0977","","","","","","1.031","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079741","33.2496","0.0003","20.4868","0.0002","19.4945","0.0002","90","","121.472","0.0005","90","","11325.7","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C44 H55 Ir N4 -","- C44 H55 Ir N4 -","- C528 H660 Ir12 N48 -","12","1.5","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C‒H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","0.71073","MoKα","","0.076","0.0539","","0.0984","0.0869","0.0984","","","","","","0.9509","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079742","32.1355","0.0004","20.8001","0.0003","20.6871","0.0003","90","","120.27","0.0006","90","","11942.5","0.3","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H59 Ir N4 -","- C46 H59 Ir N4 -","- C552 H708 Ir12 N48 -","12","1.5","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C‒H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","0.71073","MoKα","","0.1077","0.0465","","0.1022","0.0673","0.1022","","","","","","0.9979","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079743","15.11","0.0003","17.1158","0.0004","17.3974","0.0004","63.004","0.002","66.1775","0.0019","75.0989","0.0019","3652.43","0.16","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C76 H68 B F24 Ir N4 -","- C76 H68 B F24 Ir N4 -","- C152 H136 B2 F48 Ir2 N8 -","2","1","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C‒H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","1.5418","CuKα","","0.0351","0.0333","","0.0829","0.0808","0.0829","","","","","","0.9077","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079744","12.623","0.0002","16.379","0.0003","19.2977","0.0003","100.917","0.0008","104.042","0.0007","94.8383","0.0009","3764.84","0.11","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C78.5 H73 B Cl F24 Ir N4 -","- C78.5 H73 B Cl F24 Ir N4 -","- C157 H146 B2 Cl2 F48 Ir2 N8 -","2","1","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C–H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","0.71073","MoKα","","0.0988","0.0575","","0.1289","0.0958","0.1289","","","","","","0.9607","","","","has coordinates,has disorder","301830","2025-08-20","13:17:27",""
"4079745","13.8329","0.0001","16.2697","0.0002","17.7359","0.0002","91.7424","0.0004","110.893","0.0004","90.7674","0.0007","3726.17","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C76 H70 B F24 Ir N4 -","- C76 H70 B F24 Ir N4 -","- C152 H140 B2 F48 Ir2 N8 -","2","1","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C‒H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","0.71073","MoKα","","0.0533","0.0426","","0.1077","0.098","0.1077","","","","","","0.845","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079746","13.031","0.0002","14.956","0.0002","19.9381","0.0003","99.3037","0.0005","104.818","0.0006","91.3768","0.0005","3698.41","0.09","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H74 B F24 Ir N4 -","- C78 H74 B F24 Ir N4 -","- C156 H148 B2 F48 Ir2 N8 -","2","1","","Phillips, Nicholas; Rowles, Johnny; Kelly, Michael J.; Riddlestone, Ian; Rees, Nicholas H.; Dervisi, Athanasia; Fallis, Ian A.; Aldridge, Simon","Sterically Encumbered Iridium Bis(N-heterocyclic carbene) Complexes: Air-Stable 14-Electron Cations and Facile Degenerate C‒H Activation","Organometallics","2012","31","23","8075","","10.1021/om301060h","","","0.71073","MoKα","","0.0816","0.0478","","0.1143","0.0838","0.1143","","","","","","0.9598","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079747","14.6348","0.0017","25.776","0.003","13.8","0.0016","90","","90.064","0.002","90","","5205.7","1","93","","93","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27.5 H34.25 B F4 N O0.63 -","- C27.5 H33 B F4 N O0.625 -","- C220 H264 B8 F32 N8 O5 -","8","2","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.71075","MoKα","","","0.0611","","","","0.1393","","","","","","1","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079748","13.306","0.003","14.366","0.003","14.874","0.003","90","","106.669","0.003","90","","2723.7","1","93","","93","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H39 Ir N2 O -","- C31 H39 Ir N2 O -","- C124 H156 Ir4 N8 O4 -","4","1","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.71075","MoKα","","","0.0457","","","","0.1078","","","","","","1","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079749","14.278","0.004","19.086","0.005","19.509","0.005","90","","95.591","0.004","90","","5291","2","93.1","","93.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H33 Ir N3 O0.5 -","- C31 H32 Ir N3 O0.5 -","- C248 H256 Ir8 N24 O4 -","8","2","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.7107","MoKα","","","0.0357","","","","0.1014","","","","","","1.007","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079750","23.246","0.011","11.251","0.005","21.322","0.009","90","","99.203","0.007","90","","5505","4","93.1","","93.1","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H35 Ir N3 O0.5 -","- C32 H35 Ir N3 O0.5 -","- C256 H280 Ir8 N24 O4 -","8","1","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.7107","MoKα","","","0.0369","","","","0.1139","","","","","","1.01","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079751","22.6347","0.0019","10.1885","0.0005","26.0061","0.0016","90","","109.959","0.002","90","","5637.1","0.7","93.1","","93.1","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Ir N3 O2 S -","- C32 H34 Ir N3 O2 S -","- C256 H272 Ir8 N24 O16 S8 -","8","2","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.7107","MoKα","","","0.0346","","","","0.0836","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4079752","14.519","0.003","14.841","0.003","15.945","0.003","90","","98.164","0.003","90","","3401","1.2","113","","113","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H46 Ir N3 -","- C43 H46 Ir N3 -","- C172 H184 Ir4 N12 -","4","1","","Kashiwame, Yohei; Kuwata, Shigeki; Ikariya, Takao","Catalytic Intramolecular Hydroamination with a Bifunctional Iridium Pyrazolato Complex: Substrate Scope and Mechanistic Elucidation","Organometallics","2012","31","23","8444","","10.1021/om301063n","","","0.71075","MoKα","","","0.0261","","","","0.0691","","","","","","1.009","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079753","12.8039","0.0008","14.2107","0.0009","17.4436","0.0011","92.171","0.003","90.824","0.003","102.053","0.003","3100.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H80 B Li O5 -","- C75.996 H79.992 B Li O4.999 -","- C151.992 H159.984 B2 Li2 O9.998 -","2","1","","Braunschweig, Holger; Hörl, Christian; Hupp, Florian; Radacki, Krzysztof; Wahler, Johannes","Borole-Derived Spirocyclic Tetraorganoborate","Organometallics","2012","31","23","8463","","10.1021/om301070q","","","0.71073","MoKα","","0.0774","0.0536","","","0.1294","0.1435","","","","","","1.032","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079754","22.942","0.003","15.907","0.003","36.271","0.006","90","","90.922","0.004","90","","13235","4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H86 B Br P2 Pt -","- C64 H86 B Br P2 Pt -","- C512 H688 B8 Br8 P16 Pt8 -","8","1","","Braunschweig, Holger; Hörl, Christian; Hupp, Florian; Radacki, Krzysztof; Wahler, Johannes","Borole-Derived Spirocyclic Tetraorganoborate","Organometallics","2012","31","23","8463","","10.1021/om301070q","","","0.71073","MoKα","","0.0363","0.0274","","","0.0604","0.0624","","","","","","1.071","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079755","14.0647","0.0008","29.0442","0.0016","24.8349","0.0014","90","","97.855","0.002","90","","10049.8","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C122 H130 B2 Cl4 P2 Pt -","- C122 H130 B2 Cl4 P2 Pt -","- C488 H520 B8 Cl16 P8 Pt4 -","4","1","","Braunschweig, Holger; Hörl, Christian; Hupp, Florian; Radacki, Krzysztof; Wahler, Johannes","Borole-Derived Spirocyclic Tetraorganoborate","Organometallics","2012","31","23","8463","","10.1021/om301070q","","","0.71073","MoKα","","0.0576","0.034","","","0.0668","0.0748","","","","","","0.992","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079756","7.3546","0.0011","12.4212","0.0019","14.965","0.002","90","","103.296","0.003","90","","1330.5","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 Cl4 O4 Sn -","- C7 H10 Cl4 O4 Sn -","- C28 H40 Cl16 O16 Sn4 -","4","1","","Novikov, Roman A.; Balakirev, Dmitry O.; Timofeev, Vladimir P.; Tomilov, Yury V.","Complexes of Donor‒Acceptor Cyclopropanes with Tin, Titanium, and Gallium Chlorides — Mechanism Studies","Organometallics","2012","31","24","8627","","10.1021/om301072v","","","0.71073","MoKα","","0.0704","0.0592","","","0.1288","0.1406","","","","","","1.028","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079757","11.1548","0.0004","13.7581","0.0005","14.1494","0.0005","65.73","0.001","71.569","0.001","85.375","0.001","1874.97","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H25 Ge N O10 Os3 -","- C36 H25 Ge N O10 Os3 -","- C72 H50 Ge2 N2 O20 Os6 -","2","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.0372","0.0273","","","0.0515","0.0558","","","","","","1.037","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079758","18.223","0.0011","17.1315","0.0011","28.6054","0.0018","90","","90","","90","","8930.2","1","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C46 H32 Ge2 O10 Os3 -","- C46 H32 Ge2 O10 Os3 -","- C368 H256 Ge16 O80 Os24 -","8","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.0594","0.0373","","","0.0503","0.0557","","","","","","1.078","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079759","10.0493","0.0003","10.1132","0.0003","18.3249","0.0005","83.704","0.001","86.876","0.001","73.42","0.001","1773.65","0.09","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H10 Ge O17 Os5 -","- C29 H10 Ge O17 Os5 -","- C58 H20 Ge2 O34 Os10 -","2","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.068","0.0463","","","0.1003","0.112","","","","","","1.023","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079760","25.6478","0.0007","13.3284","0.0004","31.3682","0.0009","90","","105.299","0.001","90","","10343","0.5","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C49 H37 Au Ge O10 Os3 P -","- C49 H37 Au Ge O10 Os3 P -","- C392 H296 Au8 Ge8 O80 Os24 P8 -","8","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.0585","0.0397","","","0.0747","0.081","","","","","","1.072","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079761","12.6744","0.0016","10.9674","0.0014","27.57","0.004","90","","101.452","0.003","90","","3756.1","0.9","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H30 Au Ge O4 Os P -","- C40 H30 Au Ge O4 Os P -","- C160 H120 Au4 Ge4 O16 Os4 P4 -","4","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.0538","0.036","","","0.0799","0.0888","","","","","","1.015","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079762","12.1758","0.0017","14.985","0.002","17.474","0.003","107.19","0.003","108.865","0.003","91.232","0.003","2857.9","0.7","294","2","294","2","","","","","","","","8","P -1","-P 1","2","","","","- C59 H42 Au Cl2 Ge O8 Os3 P -","- C59 H42 Au Cl2 Ge O8 Os3 P -","- C118 H84 Au2 Cl4 Ge2 O16 Os6 P2 -","2","1","","Adams, Richard D.; Kan, Yuwei; Zhang, Qiang","Osmium‒Germanium and Osmium‒Germanium‒Gold Carbonyl Cluster Complexes: Syntheses, Structures, Bonding, and Reactivity","Organometallics","2012","31","24","8639","","10.1021/om301074w","","","0.71073","MoKα","","0.0644","0.0432","","","0.0951","0.1053","","","","","","1.054","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079763","17.588","0.0003","18.907","0.0004","16.774","0.0003","90","","90.123","0.003","90","","5577.95","0.18","133","2","133","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H43 Ca I O4.5 -","- C25 H43 Ca I O4.5 -","- C200 H344 Ca8 I8 O36 -","8","1","","Köhler, Mathias; Langer, Jens; Görls, Helmar; Westerhausen, Matthias","Synthesis and Molecular Structures of Meta-Substituted Arylcalcium Iodides","Organometallics","2012","31","24","8647","","10.1021/om301087e","","","0.71073","MoKα","","0.0552","0.0483","","","0.1074","0.1131","","","","","","1.138","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4079764","13.3143","0.0009","12.0557","0.0009","16.2773","0.0012","90","","91.975","0.003","90","","2611.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H41 Ca I O4 -","- C24 H41 Ca I O4 -","- C96 H164 Ca4 I4 O16 -","4","1","","Köhler, Mathias; Langer, Jens; Görls, Helmar; Westerhausen, Matthias","Synthesis and Molecular Structures of Meta-Substituted Arylcalcium Iodides","Organometallics","2012","31","24","8647","","10.1021/om301087e","","","0.71073","MoKα","","0.0383","0.0296","","","0.0656","0.069","","","","","","0.992","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079765","7.9202","0.0005","10.228","0.0007","31.556","0.002","90","","90","","90","","2556.3","0.3","133","2","133","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C22 H36 Ca Cl I O4 -","- C22 H36 Ca Cl I O4 -","- C88 H144 Ca4 Cl4 I4 O16 -","4","1","","Köhler, Mathias; Langer, Jens; Görls, Helmar; Westerhausen, Matthias","Synthesis and Molecular Structures of Meta-Substituted Arylcalcium Iodides","Organometallics","2012","31","24","8647","","10.1021/om301087e","","","0.71073","MoKα","","0.1001","0.0739","","","0.1185","0.1291","","","","","","1.291","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079766","12.1149","0.0004","13.5272","0.0003","8.3474","0.0003","90","","99.737","0.001","90","","1348.27","0.07","133","2","133","2","","","","","","","","5","C 1 m 1","C -2y","8","","","","- C26 H39 Ca I O4 -","- C26 H39 Ca I O4 -","- C52 H78 Ca2 I2 O8 -","2","0.5","","Köhler, Mathias; Langer, Jens; Görls, Helmar; Westerhausen, Matthias","Synthesis and Molecular Structures of Meta-Substituted Arylcalcium Iodides","Organometallics","2012","31","24","8647","","10.1021/om301087e","","","0.71073","MoKα","","0.0223","0.0219","","","0.0484","0.0486","","","","","","1.036","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079767","8.4998","0.0004","10.3725","0.0004","11.305","0.0005","82.272","0.001","75.246","0.001","70.505","0.001","907.24","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H21 B10 P -","- C14 H21 B10 P -","- C28 H42 B20 P2 -","2","1","","Spokoyny, Alexander M.; Lewis, Calvin D.; Teverovskiy, Georgiy; Buchwald, Stephen L.","Extremely Electron-Rich, Boron-Functionalized, Icosahedral Carborane-Based Phosphinoboranes.","Organometallics","2012","31","24","8478","8481","10.1021/om301116x","","","0.71073","MoKα","","0.0354","0.0323","","","0.0894","0.0922","","","","","","1.053","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079768","23.437","0.003","9.0908","0.001","25.04","0.003","90","","115.647","0.002","90","","4809.4","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H54 B20 Cl4 P2 Pt2 -","- C36 H54 B20 Cl4 P2 Pt2 -","- C144 H216 B80 Cl16 P8 Pt8 -","4","0.5","","Spokoyny, Alexander M.; Lewis, Calvin D.; Teverovskiy, Georgiy; Buchwald, Stephen L.","Extremely Electron-Rich, Boron-Functionalized, Icosahedral Carborane-Based Phosphinoboranes.","Organometallics","2012","31","24","8478","8481","10.1021/om301116x","","","0.71073","MoKα","","0.0347","0.0293","","","0.0794","0.0828","","","","","","1.051","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079769","12.652","0.002","9.6243","0.0016","13.932","0.002","90","","92.408","0.003","90","","1695","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H28 B11 P -","- C8 H28 B11 P -","- C32 H112 B44 P4 -","4","1","","Spokoyny, Alexander M.; Lewis, Calvin D.; Teverovskiy, Georgiy; Buchwald, Stephen L.","Extremely Electron-Rich, Boron-Functionalized, Icosahedral Carborane-Based Phosphinoboranes.","Organometallics","2012","31","24","8478","8481","10.1021/om301116x","","","0.71073","MoKα","","0.0348","0.0304","","","0.0869","0.0908","","","","","","1.047","","","","has coordinates","178686","2020-10-21","18:00:00",""
"4079770","10.5035","0.0006","15.583","0.0009","24.2564","0.0014","90","","96.405","0.001","90","","3945.4","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H42 B20 Cl O P2 Rh -","- C29 H42 B20 Cl O P2 Rh -","- C116 H168 B80 Cl4 O4 P8 Rh4 -","4","1","","Spokoyny, Alexander M.; Lewis, Calvin D.; Teverovskiy, Georgiy; Buchwald, Stephen L.","Extremely Electron-Rich, Boron-Functionalized, Icosahedral Carborane-Based Phosphinoboranes.","Organometallics","2012","31","24","8478","8481","10.1021/om301116x","","","0.71073","MoKα","","0.0254","0.0224","","","0.0588","0.0607","","","","","","1.086","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079771","9.7592","0.0011","10.8951","0.0012","13.356","0.0015","81.811","0.002","69.787","0.002","81.164","0.002","1310.7","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H72 B20 Cl7 O P2 Rh -","- C32 H72 B20 Cl7 O P2 Rh -","- C32 H72 B20 Cl7 O P2 Rh -","1","0.5","","Spokoyny, Alexander M.; Lewis, Calvin D.; Teverovskiy, Georgiy; Buchwald, Stephen L.","Extremely Electron-Rich, Boron-Functionalized, Icosahedral Carborane-Based Phosphinoboranes.","Organometallics","2012","31","24","8478","8481","10.1021/om301116x","","","0.71073","MoKα","","0.0247","0.024","","","0.061","0.0613","","","","","","1.29","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4079772","12.1397","0.0016","12.5454","0.0017","18.85","0.003","90","","90.676","0.002","90","","2870.6","0.7","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H38 B F4 O6 Os P -","- C25 H38 B F4 O6 Os P -","- C100 H152 B4 F16 O24 Os4 P4 -","4","1","","Batuecas, María; Esteruelas, Miguel A.; Garc\?ía-Yebra, Cristina; Oñate, Enrique","Osmium-Centered Oxetylidene: Formation and Cleavage","Organometallics","2012","31","23","8079","","10.1021/om3011323","","","0.71073","MoKα","","0.0832","0.0523","","","0.1034","0.1174","","","","","","1.05","","","","has coordinates,has disorder","178686","2020-10-21","18:00:00",""
"4083217","11.5045","0.0004","25.1151","0.0009","6.8545","0.0002","90","","92.643","0.001","90","","1978.41","0.11","103","2","103","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 O10 P W -","- C17 H13 O10 P W -","- C68 H52 O40 P4 W4 -","4","1","","Mao, Yanli; Wang, Zhiyue; Ganguly, Rakesh; Mathey, François","Generation and Reactivity of Methylphosphaketene in the Coordination Sphere of Tungsten","Organometallics","2012","31","13","4786","","10.1021/om300333v","","","0.71073","MoKα","","0.0584","0.0349","","","0.0745","0.0968","","","","","","1.017","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083218","7.3278","0.0004","9.5939","0.0006","14.7198","0.0009","92.056","0.002","90.503","0.001","95.518","0.001","1029.3","0.11","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H22 N O5 P W -","- C18 H22 N O5 P W -","- C36 H44 N2 O10 P2 W2 -","2","1","","Mao, Yanli; Wang, Zhiyue; Ganguly, Rakesh; Mathey, François","Generation and Reactivity of Methylphosphaketene in the Coordination Sphere of Tungsten","Organometallics","2012","31","13","4786","","10.1021/om300333v","","","0.71073","MoKα","","0.0245","0.0223","","","0.0525","0.054","","","","","","1.051","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083219","16.6772","0.0019","14.3498","0.0016","22.951","0.003","90","","90","","90","","5492.5","1.1","291","2","291","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C72 H106 B40 Co4 N4 O17 S12 -","- C72 H106 B40 Co4 N4 O17 S12 -","- C144 H212 B80 Co8 N8 O34 S24 -","2","0.25","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0688","0.0519","","","0.1192","0.1237","","","","","","1.041","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083220","35.295","0.008","6.5329","0.0015","21.116","0.005","90","","121.01","0.002","90","","4173","1.7","291","2","291","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H38 B20 Co2 N2 O5 S4 -","- C18 H38 B20 Co2 N2 O5 S4 -","- C72 H152 B80 Co8 N8 O20 S16 -","4","0.5","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0632","0.0512","","","0.1215","0.1285","","","","","","1.093","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083221","18.303","0.004","15.749","0.004","19.462","0.005","90","","90","","90","","5610","2","291","2","291","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H28 B10 Co N O2 S3 -","- C22 H28 B10 Co N O2 S3 -","- C176 H224 B80 Co8 N8 O16 S24 -","8","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0556","0.0446","","","0.1097","0.1128","","","","","","1.095","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083222","37.882","0.019","14.995","0.008","12.883","0.006","90","","97.078","0.005","90","","7262","6","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H40 B10 Co N O5 S3 -","- C28 H40 B10 Co N O5 S3 -","- C224 H320 B80 Co8 N8 O40 S24 -","8","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.1542","0.0724","","","0.1762","0.2089","","","","","","0.963","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083223","11.2355","0.0011","10.3427","0.001","18.2138","0.0018","90","","97.37","0.001","90","","2099.1","0.4","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 B10 Co N O S2 -","- C14 H20 B10 Co N O S2 -","- C56 H80 B40 Co4 N4 O4 S8 -","4","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0535","0.0413","","","0.0978","0.1024","","","","","","0.929","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083224","16.778","0.004","14.901","0.003","9.602","0.002","90","","102.633","0.003","90","","2342.5","0.9","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 B10 Co N O2 S3 -","- C14 H22 B10 Co N O2 S3 -","- C56 H88 B40 Co4 N4 O8 S12 -","4","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.057","0.0393","","","0.083","0.0875","","","","","","0.894","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083225","14.6451","0.0012","15.4289","0.0013","11.2169","0.0009","90","","109.45","0.001","90","","2389.9","0.3","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 B10 Co N O2 S3 -","- C14 H28 B10 Co N O2 S3 -","- C56 H112 B40 Co4 N4 O8 S12 -","4","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0561","0.0384","","","0.085","0.0911","","","","","","1.021","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083226","23.6733","0.0017","12.1592","0.0009","21.784","0.002","90","","121.224","0.001","90","","5362.2","0.7","273","2","273","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C33 H50 B20 Cl2 Co2 N2 O4 S6 -","- C33 H50 B20 Cl2 Co2 N2 O4 S6 -","- C132 H200 B80 Cl8 Co8 N8 O16 S24 -","4","0.5","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0587","0.0503","","","0.1663","0.1719","","","","","","1.044","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083227","18.661","0.0017","7.4635","0.0007","38.315","0.004","90","","90","","90","","5336.4","0.9","273","2","273","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C18 H26 B10 Co N O4 S3 -","- C18 H26 B10 Co N O4 S3 -","- C144 H208 B80 Co8 N8 O32 S24 -","8","2","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0787","0.0578","","","0.1353","0.1426","","","","","","1.061","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083228","13.9615","0.0015","15.6397","0.0012","19.696","0.002","74.878","0.001","69.511","0.005","65.522","0.001","3632.5","0.6","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H62 B20 Co2 N2 O15 S6 -","- C40 H62 B20 Co2 N2 O15 S6 -","- C80 H124 B40 Co4 N4 O30 S12 -","2","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0999","0.0652","","","0.1377","0.1457","","","","","","1.064","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083229","11.8988","0.0015","26.95","0.003","6.3029","0.0008","90","","90","","90","","2021.2","0.4","296","2","296","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C19 H21 B0 Co N4 O4 S2 -","- C19 H19 Co N4 O4 S2 -","- C76 H76 Co4 N16 O16 S8 -","4","0.5","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.055","0.0386","","","0.0855","0.0895","","","","","","1.013","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083230","13.96","0.003","14.946","0.003","18.549","0.003","90","","126.299","0.01","90","","3119.1","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H30 B10 Co N O4 S3 -","- C24 H30 B10 Co N O4 S3 -","- C96 H120 B40 Co4 N4 O16 S12 -","4","1","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0654","0.048","","","0.1318","0.143","","","","","","1.001","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083231","16.8057","0.0011","9.1775","0.0006","16.297","0.0011","90","","97.854","0.001","90","","2490","0.3","273","2","273","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 B0 Co N4 O4 S2 -","- C7 H11 Co N4 O4 S2 -","- C56 H88 Co8 N32 O32 S16 -","8","2","","Zhong, Wei; Yang, Qiwu; Shang, Yi; Liu, Guifeng; Zhao, Haitao; Li, Yizhi; Yan, Hong","Synthesis and Reactivity of the Imido-Bridged Metallothiocarboranes CpCo(S2C2B10H10)(NSO2R)","Organometallics","2012","31","18","6658","","10.1021/om300735d","","","0.71073","MoKα","","0.0384","0.0285","","","0.07","0.0738","","","","","","1.048","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083232","17.9027","0.0008","9.7996","0.0005","12.292","0.0006","90","","113.2","0.003","90","","1982.12","0.17","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 F4 Fe O2 -","- C22 H24 F4 Fe O2 -","- C88 H96 F16 Fe4 O8 -","4","0.5","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.0414","0.0315","","","0.0776","0.0816","","","","","","1.037","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083233","11.625","0.003","11.885","0.003","11.972","0.003","94.11","0.006","112.635","0.006","113.211","0.005","1353.6","0.6","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 F4 Fe2 O -","- C32 H34 F4 Fe2 O -","- C64 H68 F8 Fe4 O2 -","2","1","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.0976","0.0579","","","0.1428","0.1548","","","","","","1.077","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083234","13.68","0.002","17.241","0.003","17.751","0.003","90","","100.453","0.004","90","","4117.2","1.2","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 F7 Fe -","- C22 H25 F7 Fe -","- C176 H200 F56 Fe8 -","8","2","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.0757","0.0632","","","0.1752","0.1904","","","","","","1.031","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083235","16.578","0.002","10.0275","0.0018","25.858","0.003","90","","107.056","0.006","90","","4109.5","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H25 F5 Fe O -","- C22 H25 F5 Fe O -","- C176 H200 F40 Fe8 O8 -","8","1","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.0628","0.0422","","","0.1176","0.1286","","","","","","1.042","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083236","11.4823","0.0014","12.1707","0.0016","16.552","0.003","90","","90","","90","","2313.1","0.6","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H34 F4 Fe O -","- C26 H34 F4 Fe O -","- C104 H136 F16 Fe4 O4 -","4","1","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.043","0.0337","","","0.0734","0.0775","","","","","","1.06","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083237","9.7791","0.0003","17.6134","0.0008","11.5627","0.0003","90","","97.786","0.002","90","","1973.24","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 Fe I2 -","- C18 H24 Fe I2 -","- C72 H96 Fe4 I8 -","4","1","","Roemer, Max; Heinrich, Darina; Kang, Youn Kyung; Chung, Young Keun; Lentz, Dieter","Bulky-Alkyl-Substituted Bis(trifluorovinyl)ferrocenes: Redox-Autocatalytic Formation of Fluorinated Ferrocenophanes","Organometallics","2012","31","4","1500","","10.1021/om2009765","","","0.71073","MoKα","","0.0504","0.0423","","","0.1134","0.1205","","","","","","1.04","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083238","6.6462","0.0018","7.192","0.003","15.591","0.006","77.381","0.01","89.5","0.02","73.77","0.02","697.2","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H13 Fe O7 P -","- C11 H13 Fe O7 P -","- C22 H26 Fe2 O14 P2 -","2","1","","Romanski, Steffen; Rücker, Hannelore; Stamellou, Eleni; Guttentag, Miguel; Neudörfl, Jörg-Martin; Alberto, Roger; Amslinger, Sabine; Yard, Benito; Schmalz, Hans-Günther","Iron Dienylphosphate Tricarbonyl Complexes as Water-Soluble Enzyme-Triggered CO-Releasing Molecules (ET-CORMs)","Organometallics","2012","31","16","5800","","10.1021/om300359a","","","0.71073","MoKα","","0.0959","0.0559","","","0.1072","0.1249","","","","","","1.074","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083239","11.0155","0.0006","13.7958","0.0009","12.1604","0.0007","90","","120.31","0.004","90","","1595.38","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 Fe N2 O5 P -","- C13 H19 Fe N2 O5 P -","- C52 H76 Fe4 N8 O20 P4 -","4","1","","Romanski, Steffen; Rücker, Hannelore; Stamellou, Eleni; Guttentag, Miguel; Neudörfl, Jörg-Martin; Alberto, Roger; Amslinger, Sabine; Yard, Benito; Schmalz, Hans-Günther","Iron Dienylphosphate Tricarbonyl Complexes as Water-Soluble Enzyme-Triggered CO-Releasing Molecules (ET-CORMs)","Organometallics","2012","31","16","5800","","10.1021/om300359a","","","0.71073","MoKα","","0.0658","0.0358","","","0.0731","0.0804","","","","","","0.98","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083240","6.015","0.0004","11.6531","0.001","15.98","0.001","92.141","0.004","91.224","0.005","103.674","0.0005","1087.06","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H21 Fe O7 P -","- C23 H21 Fe O7 P -","- C46 H42 Fe2 O14 P2 -","2","1","","Romanski, Steffen; Rücker, Hannelore; Stamellou, Eleni; Guttentag, Miguel; Neudörfl, Jörg-Martin; Alberto, Roger; Amslinger, Sabine; Yard, Benito; Schmalz, Hans-Günther","Iron Dienylphosphate Tricarbonyl Complexes as Water-Soluble Enzyme-Triggered CO-Releasing Molecules (ET-CORMs)","Organometallics","2012","31","16","5800","","10.1021/om300359a","","","0.71073","MoKα","","0.079","0.0438","","","0.0784","0.0888","","","","","","1.01","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083241","6.2236","0.0002","27.465","0.002","10.2669","0.0005","90","","114.728","0.003","90","","1594.01","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 Fe N2 O5 P -","- C13 H19 Fe N2 O5 P -","- C52 H76 Fe4 N8 O20 P4 -","4","1","","Romanski, Steffen; Rücker, Hannelore; Stamellou, Eleni; Guttentag, Miguel; Neudörfl, Jörg-Martin; Alberto, Roger; Amslinger, Sabine; Yard, Benito; Schmalz, Hans-Günther","Iron Dienylphosphate Tricarbonyl Complexes as Water-Soluble Enzyme-Triggered CO-Releasing Molecules (ET-CORMs)","Organometallics","2012","31","16","5800","","10.1021/om300359a","","","0.71073","MoKα","","0.0457","0.0314","","","0.0719","0.0756","","","","","","1.063","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083242","15.9906","0.0001","16.97","0.0001","18.3","0.0001","90","","98.6806","0.0002","90","","4909.01","0.05","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H71 Fe2 Ge2 Se -","- C53 H71 Fe2 Ge2 Se -","- C212 H284 Fe8 Ge8 Se4 -","4","1","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.75","synchrotron","","0.0412","0.0367","","","0.0904","0.0934","","","","","","1.017","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4083243","9.5444","0.0003","10.878","0.0002","13.11","0.0003","68.8974","0.001","72.1442","0.0013","67.528","0.003","1150.66","0.05","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C50 H64 Fe2 Ge2 -","- C50 H64 Fe2 Ge2 -","- C50 H64 Fe2 Ge2 -","1","0.5","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71075","MoKα","","0.0371","0.0342","","","0.0849","0.0872","","","","","","1.046","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083244","10.4736","0.0004","11.123","0.0006","11.1532","0.0005","95.465","0.002","104.884","0.003","97.034","0.003","1235.36","0.1","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H32 Br2 Fe Ge -","- C25 H32 Br2 Fe Ge -","- C50 H64 Br4 Fe2 Ge2 -","2","1","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.7107","MoKα","","0.0303","0.0246","","","0.0591","0.0605","","","","","","1.008","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083245","15.9943","0.0002","16.9639","0.0002","18.2615","0.0003","90","","98.7239","0.0012","90","","4897.49","0.12","103","2","103","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53 H71 Fe2 Ge2 S -","- C53 H71 Fe2 Ge2 S -","- C212 H284 Fe8 Ge8 S4 -","4","1","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71075","MoKα","","0.0354","0.0315","","","0.0783","0.0808","","","","","","1.032","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083246","12.7367","0.0002","12.9147","0.0002","18.0517","0.0004","109.628","0.0009","104.893","0.0011","96.7964","0.0009","2633.62","0.09","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H78 Fe2 Ge2 S2 -","- C56 H78 Fe2 Ge2 S2 -","- C112 H156 Fe4 Ge4 S4 -","2","1","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71075","MoKα","","0.0321","0.0285","","","0.0729","0.0754","","","","","","1.046","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083247","12.8918","0.0005","18.9669","0.0008","23.1098","0.001","72.853","0.002","76.859","0.004","79.692","0.003","5220","0.4","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C59 H81 Fe2 Ge2 -","- C59 H81 Fe2 Ge2 -","- C236 H324 Fe8 Ge8 -","4","2","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71075","MoKα","","0.1852","0.0889","","","0.1278","0.1618","","","","","","1.134","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083248","9.1574","0.0003","9.8986","0.0002","16.11","0.0004","74.4417","0.0009","75.488","0.002","80.8159","0.0013","1355.21","0.06","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H42 Fe Ge -","- C31 H42 Fe Ge -","- C62 H84 Fe2 Ge2 -","2","1","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71069","MoKα","","0.0317","0.0252","","","0.0569","0.0597","","","","","","1.025","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083249","9.2367","0.0002","10.9748","0.0002","11.4772","0.0002","99.579","0.0008","97.8753","0.0009","93.8906","0.0019","1131.51","0.04","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H64 Fe2 Ge2 O2 -","- C50 H64 Fe2 Ge2 O2 -","- C50 H64 Fe2 Ge2 O2 -","1","0.5","","Sasamori, Takahiro; Miyamoto, Hisashi; Sakai, Heisuke; Furukawa, Yukio; Tokitoh, Norihiro","1,2-Bis(ferrocenyl)digermene: A d−π Electron System Containing a Ge═Ge Unit","Organometallics","2012","31","10","3904","","10.1021/om300064q","","","0.71075","MoKα","","0.0264","0.0259","","","0.0689","0.0695","","","","","","1.07","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083250","25.6331","0.0017","15.4787","0.0011","30.772","0.002","90","","97.328","0.002","90","","12109.6","1.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C65.5 H48 Bi Ge3 Ir3 O6 -","- C65.5 H48 Bi Ge3 Ir3 O6 -","- C524 H384 Bi8 Ge24 Ir24 O48 -","8","1","","Adams, Richard D.; Chen, Mingwei; Elpitiya, Gaya; Zhang, Qiang","Synthesis and Characterizations of Bismuth-Bridged Triiridium Carbonyl Complexes Containing Germyl/Germylene and Stannyl/Stannylene Ligands","Organometallics","2012","31","20","7264","","10.1021/om300813t","","","0.71073","MoKα","","0.07","0.0586","","","0.1351","0.1402","","","","","","1.084","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083251","33.584","0.017","14.609","0.006","37.282","0.016","90","","98.623","0.014","90","","18085","14","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C42.25 H30.5 Bi Cl0.5 Ge3 Ir3 O6 -","- C42.25 H30.5 Bi Cl0.5 Ge3 Ir3 O6 -","- C676 H488 Bi16 Cl8 Ge48 Ir48 O96 -","16","2","","Adams, Richard D.; Chen, Mingwei; Elpitiya, Gaya; Zhang, Qiang","Synthesis and Characterizations of Bismuth-Bridged Triiridium Carbonyl Complexes Containing Germyl/Germylene and Stannyl/Stannylene Ligands","Organometallics","2012","31","20","7264","","10.1021/om300813t","","","0.71073","MoKα","","0.1291","0.0637","","","0.1345","0.1665","","","","","","1.037","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4083252","15.4058","0.0002","15.4058","0.0002","30.9544","0.0007","90","","90","","120","","6362.41","0.19","294","2","294","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","","","- C20 H16 Bi0.33 Ir O2 Sn -","- C20 H16 Bi0.333333 Ir O2 Sn -","- C240 H192 Bi4 Ir12 O24 Sn12 -","12","2","","Adams, Richard D.; Chen, Mingwei; Elpitiya, Gaya; Zhang, Qiang","Synthesis and Characterizations of Bismuth-Bridged Triiridium Carbonyl Complexes Containing Germyl/Germylene and Stannyl/Stannylene Ligands","Organometallics","2012","31","20","7264","","10.1021/om300813t","","","0.71073","MoKα","","0.0456","0.0354","","","0.0838","0.0944","","","","","","1.096","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083253","12.4372","0.0003","12.4372","0.0003","38.7624","0.0019","90","","90","","120","","5192.6","0.3","294","2","294","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","","","- C14 H10 Bi0.33 Ir O2 Sn -","- C14 H10 Bi0.333333 Ir O2 Sn -","- C168 H120 Bi4 Ir12 O24 Sn12 -","12","2","","Adams, Richard D.; Chen, Mingwei; Elpitiya, Gaya; Zhang, Qiang","Synthesis and Characterizations of Bismuth-Bridged Triiridium Carbonyl Complexes Containing Germyl/Germylene and Stannyl/Stannylene Ligands","Organometallics","2012","31","20","7264","","10.1021/om300813t","","","0.71073","MoKα","","0.0535","0.045","","","0.1055","0.1095","","","","","","1.09","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083254","9.0518","0.0019","25.921","0.005","16.471","0.003","90","","94.024","0.005","90","","3855.1","1.3","93","2","93","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H49 Cl2 N2 O4 P Ru -","- C40 H45 Cl2 N2 O4 P Ru -","- C160 H180 Cl8 N8 O16 P4 Ru4 -","4","1","","Bantreil, Xavier; Poater, Albert; Urbina-Blanco, César A.; Bidal, Yannick D.; Falivene, Laura; Randall, Rebecca A. M.; Cavallo, Luigi; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Synthesis and Reactivity of Ruthenium Phosphite Indenylidene Complexes","Organometallics","2012","31","21","7415","","10.1021/om300703p","","","0.71073","MoKα","","0.0617","0.0481","","","0.1252","0.1348","","","","","","1.053","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083255","11.9325","0.0004","7.616","0.0003","16.9071","0.0005","90","","95.133","0.002","90","","1530.32","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H19 Br N2 Pt -","- C15 H19 Br N2 Pt -","- C60 H76 Br4 N8 Pt4 -","4","1","","Hoseini, S. Jafar; Nasrabadi, Hasan; Nabavizadeh, S. Masoud; Rashidi, Mehdi; Puddephatt, Richard J.","Reactivity and Mechanism in the Oxidative Addition of Allylic Halides to a Dimethylplatinum(II) Complex","Organometallics","2012","31","6","2357","","10.1021/om201289e","","","0.71073","MoKα","","0.0521","0.0313","","","0.0656","0.0735","","","","","","1.025","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083256","11.8284","0.0005","8.0909","0.0003","16.7531","0.0006","90","","94.671","0.002","90","","1597.99","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 Cl N2 Pt -","- C16 H21 Cl N2 Pt -","- C64 H84 Cl4 N8 Pt4 -","4","1","","Hoseini, S. Jafar; Nasrabadi, Hasan; Nabavizadeh, S. Masoud; Rashidi, Mehdi; Puddephatt, Richard J.","Reactivity and Mechanism in the Oxidative Addition of Allylic Halides to a Dimethylplatinum(II) Complex","Organometallics","2012","31","6","2357","","10.1021/om201289e","","","0.71073","MoKα","","0.0446","0.0321","","","0.0522","0.0566","","","","","","1.092","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083257","8.8825","0.0006","16.2365","0.001","24.5646","0.0015","90","","96.92","0.001","90","","3516.9","0.4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H61 B10 N3 O -","- C28 H61 B10 N3 O -","- C112 H244 B40 N12 O4 -","4","1","","Mindich, Aleksey L.; Bokach, Nadezhda A.; Dolgushin, Fedor M.; Haukka, Matti; Lisitsyn, Leonid A.; Zhdanov, Andrey P.; Zhizhin, Konstantin Yu.; Miltsov, Serguei A.; Kuznetsov, Nikolay T.; Kukushkin, Vadim Yu.","1,3-Dipolar Cycloaddition of Nitrones to a Nitrile Functionality incloso-Decaborate Clusters: A Novel Reactivity Mode for the Borylated C≡N Group","Organometallics","2012","31","5","1716","","10.1021/om200993f","","","0.71073","MoKα","","0.0811","0.0532","","","0.1249","0.1468","","","","","","1.011","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083258","8.8362","0.0005","17.059","0.0008","23.2056","0.0012","90","","97.877","0.002","90","","3464.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H59 B10 N3 O2 -","- C27 H59 B10 N3 O2 -","- C108 H236 B40 N12 O8 -","4","1","","Mindich, Aleksey L.; Bokach, Nadezhda A.; Dolgushin, Fedor M.; Haukka, Matti; Lisitsyn, Leonid A.; Zhdanov, Andrey P.; Zhizhin, Konstantin Yu.; Miltsov, Serguei A.; Kuznetsov, Nikolay T.; Kukushkin, Vadim Yu.","1,3-Dipolar Cycloaddition of Nitrones to a Nitrile Functionality incloso-Decaborate Clusters: A Novel Reactivity Mode for the Borylated C≡N Group","Organometallics","2012","31","5","1716","","10.1021/om200993f","","","0.71073","MoKα","","0.0975","0.05","","","0.1106","0.132","","","","","","1.003","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083259","8.6149","0.0007","16.1842","0.0013","24.9693","0.0019","90","","98.398","0.002","90","","3444","0.5","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H59 B10 N3 O -","- C27 H59 B10 N3 O -","- C108 H236 B40 N12 O4 -","4","1","","Mindich, Aleksey L.; Bokach, Nadezhda A.; Dolgushin, Fedor M.; Haukka, Matti; Lisitsyn, Leonid A.; Zhdanov, Andrey P.; Zhizhin, Konstantin Yu.; Miltsov, Serguei A.; Kuznetsov, Nikolay T.; Kukushkin, Vadim Yu.","1,3-Dipolar Cycloaddition of Nitrones to a Nitrile Functionality incloso-Decaborate Clusters: A Novel Reactivity Mode for the Borylated C≡N Group","Organometallics","2012","31","5","1716","","10.1021/om200993f","","","0.71073","MoKα","","0.0969","0.0645","","","0.1362","0.1586","","","","","","1.034","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083260","11.471","0.004","14.344","0.005","15.534","0.006","90","","110.777","0.004","90","","2389.7","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl N2 Rh -","- C25 H36 Cl N2 Rh -","- C100 H144 Cl4 N8 Rh4 -","4","1","","Zhang, Jun; Qin, Xinke; Fu, Jun; Wang, Xiao; Su, Xiaolong; Hu, Fangle; Jiao, Jiajun; Shi, Min","Fine-Tunable 3,4-Dihydroquinazol-2-ylidene Carbenes: Synthesis, Rhodium(I) Complexes, and Reactivity","Organometallics","2012","31","23","8275","","10.1021/om300887y","","","0.71073","MoKα","","0.043","0.032","","","0.0791","0.0839","","","","","","1.048","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083261","17.6029","0.0005","10.3894","0.0003","13.4838","0.0003","90","","102.376","0.001","90","","2408.66","0.11","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 Cl N2 Rh -","- C26 H28 Cl N2 Rh -","- C104 H112 Cl4 N8 Rh4 -","4","1","","Zhang, Jun; Qin, Xinke; Fu, Jun; Wang, Xiao; Su, Xiaolong; Hu, Fangle; Jiao, Jiajun; Shi, Min","Fine-Tunable 3,4-Dihydroquinazol-2-ylidene Carbenes: Synthesis, Rhodium(I) Complexes, and Reactivity","Organometallics","2012","31","23","8275","","10.1021/om300887y","","","0.71073","MoKα","","0.0327","0.0272","","","0.0771","0.0879","","","","","","1.097","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083262","7.175","0.004","11.396","0.007","21.66","0.012","90","","90","","90","","1771.1","1.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H25 I N2 -","- C17 H25 I N2 -","- C68 H100 I4 N8 -","4","1","","Zhang, Jun; Qin, Xinke; Fu, Jun; Wang, Xiao; Su, Xiaolong; Hu, Fangle; Jiao, Jiajun; Shi, Min","Fine-Tunable 3,4-Dihydroquinazol-2-ylidene Carbenes: Synthesis, Rhodium(I) Complexes, and Reactivity","Organometallics","2012","31","23","8275","","10.1021/om300887y","","","0.71073","MoKα","","0.036","0.031","","","0.0746","0.0772","","","","","","1.025","","","","has coordinates","301831","2025-08-20","13:52:14",""
"4083263","11.043","0.004","15.067","0.005","17.029","0.006","90","","91.66","0.005","90","","2832.2","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H44 Cl N2 Rh -","- C29 H44 Cl N2 Rh -","- C116 H176 Cl4 N8 Rh4 -","4","1","","Zhang, Jun; Qin, Xinke; Fu, Jun; Wang, Xiao; Su, Xiaolong; Hu, Fangle; Jiao, Jiajun; Shi, Min","Fine-Tunable 3,4-Dihydroquinazol-2-ylidene Carbenes: Synthesis, Rhodium(I) Complexes, and Reactivity","Organometallics","2012","31","23","8275","","10.1021/om300887y","","","0.71073","MoKα","","0.0542","0.0352","","","0.0695","0.0742","","","","","","0.92","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083265","12.3601","0.0002","14.9918","0.0002","24.2825","0.0003","90","","90","","90","","4499.55","0.11","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C54 H59 B Cl Ir N2 -","- C54 H59 B Cl Ir N2 -","- C216 H236 B4 Cl4 Ir4 N8 -","4","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0399","0.0295","","","0.0507","0.0529","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4083266","13.338","0.0002","14.6435","0.0002","18.9118","0.0003","90","","95.442","0.001","90","","3677.11","0.09","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H47 B Cl Ir N4 -","- C43 H47 B Cl Ir N4 -","- C172 H188 B4 Cl4 Ir4 N16 -","4","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0491","0.0336","","","0.0698","0.0736","","","","","","1.061","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4083267","12.1897","0.0001","12.962","0.0001","16.5879","0.0002","97.506","0.001","100.475","0.001","92.098","0.001","2550.27","0.04","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C55.8 H63.2 B Cl Ir N2 P -","- C55.8 H63.2 B Cl Ir N2 P -","- C111.6 H126.4 B2 Cl2 Ir2 N4 P2 -","2","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0362","0.0286","","","0.0704","0.0726","","","","","","1.06","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4083268","19.6897","0.0002","25.1941","0.0003","17.6879","0.0002","90","","90","","90","","8774.34","0.17","100","2","100","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","","","- C50 H53 B Cl Ir N4 -","- C50 H53 B Cl Ir N4 -","- C400 H424 B8 Cl8 Ir8 N32 -","8","","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0332","0.0237","","","0.0498","0.0522","","","","","","1.018","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4083269","11.469","0.0002","13.459","0.0001","16.6804","0.0002","93.841","0.001","105.473","0.001","96.914","0.001","2450.19","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C59 H51 B Cl5 Ir N2 -","- C59 H51 B Cl5 Ir N2 -","- C118 H102 B2 Cl10 Ir2 N4 -","2","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0347","0.0278","","","0.0659","0.0679","","","","","","1.065","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4083270","12.3057","0.0007","14.9864","0.0008","24.3301","0.0016","90","","90","","90","","4486.9","0.5","90","2","90","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C54 H59 B Cl N2 Rh -","- C54 H59 B Cl N2 Rh -","- C216 H236 B4 Cl4 N8 Rh4 -","4","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0519","0.0388","","","0.0769","0.0812","","","","","","0.99","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4083271","13.2866","0.0005","14.6089","0.0004","18.9761","0.0006","90","","95.704","0.001","90","","3665.1","0.2","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H47 B Cl N4 Rh -","- C43 H47 B Cl N4 Rh -","- C172 H188 B4 Cl4 N16 Rh4 -","4","1","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0762","0.0415","","","0.0837","0.091","","","","","","0.997","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4083272","19.6719","0.0013","25.202","0.0015","17.6312","0.0009","90","","90","","90","","8741","0.9","90","2","90","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","","","- C50 H53 B Cl N4 Rh -","- C50 H53 B Cl N4 Rh -","- C400 H424 B8 Cl8 N32 Rh8 -","8","","","Gray, Katherine; Page, Michael J.; Wagler, Jörg; Messerle, Barbara A.","Iridium(III) Cp* Complexes for the Efficient Hydroamination of Internal Alkynes","Organometallics","2012","31","17","6270","","10.1021/om300550k","","","0.71073","MoKα","","0.0878","0.0402","","","0.0722","0.0826","","","","","","0.992","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4083273","14.692","0.003","22.825","0.004","9.1192","0.0018","90","","100.168","0.002","90","","3010","1","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H47 B K O6 P -","- C25 H47 B K O6 P -","- C100 H188 B4 K4 O24 P4 -","4","1","","Macha, Bret B.; Boudreau, Josée; Maron, Laurent; Maris, Thierry; Fontaine, Frédéric-Georges","Coordination of a Di-tert-butylphosphidoboratabenzene Ligand to Electronically Unsaturated Group 10 Transition Metals","Organometallics","2012","31","17","6428","","10.1021/om300668u","","","0.71073","MoKα","","0.1065","0.0542","","","0.1151","0.1394","","","","","","1.016","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083274","23.8882","0.0003","23.8882","0.0003","14.1077","0.0003","90","","90","","120","","6971.94","0.19","110","2","110","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C13 H23 B K P -","- C13 H23 B K P -","- C234 H414 B18 K18 P18 -","18","1","","Macha, Bret B.; Boudreau, Josée; Maron, Laurent; Maris, Thierry; Fontaine, Frédéric-Georges","Coordination of a Di-tert-butylphosphidoboratabenzene Ligand to Electronically Unsaturated Group 10 Transition Metals","Organometallics","2012","31","17","6428","","10.1021/om300668u","","","1.54178","CuKα","","0.0451","0.0442","","","0.1081","0.1088","","","","","","1.038","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083275","21.8531","0.0007","14.5902","0.0005","9.039","0.0003","90","","107.204","0.001","90","","2753.06","0.16","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H46 B2 Ni2 P2 -","- C26 H46 B2 Ni2 P2 -","- C104 H184 B8 Ni8 P8 -","4","0.5","","Macha, Bret B.; Boudreau, Josée; Maron, Laurent; Maris, Thierry; Fontaine, Frédéric-Georges","Coordination of a Di-tert-butylphosphidoboratabenzene Ligand to Electronically Unsaturated Group 10 Transition Metals","Organometallics","2012","31","17","6428","","10.1021/om300668u","","","1.54178","CuKα","","0.0337","0.0335","","","0.0891","0.0892","","","","","","1.144","","","","has coordinates,has disorder","301831","2025-08-20","13:52:14",""
"4083276","8.65","0.0017","11.99","0.002","18.21","0.004","106.09","0.03","94.29","0.03","103.88","0.03","1741.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H60 B2 P2 Pt -","- C37 H60 B2 P2 Pt -","- C74 H120 B4 P4 Pt2 -","2","1","","Macha, Bret B.; Boudreau, Josée; Maron, Laurent; Maris, Thierry; Fontaine, Frédéric-Georges","Coordination of a Di-tert-butylphosphidoboratabenzene Ligand to Electronically Unsaturated Group 10 Transition Metals","Organometallics","2012","31","17","6428","","10.1021/om300668u","","","1.54178","CuKα","","0.0965","0.0818","","","0.2117","0.2258","","","","","","1.183","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083277","9.3833","0.0003","10.6385","0.0004","21.9552","0.0008","77.0532","0.0014","83.1099","0.0013","77.0269","0.0012","2075.82","0.13","150","","150","","","","","","","","Synthesized by the authors. See text","5","P -1","-P 1","2","","","","- C26 H46 B2 P2 Pt -","- C26 H46 B2 P2 Pt -","- C78 H138 B6 P6 Pt3 -","3","1.5","","Macha, Bret B.; Boudreau, Josée; Maron, Laurent; Maris, Thierry; Fontaine, Frédéric-Georges","Coordination of a Di-tert-butylphosphidoboratabenzene Ligand to Electronically Unsaturated Group 10 Transition Metals","Organometallics","2012","31","17","6428","","10.1021/om300668u","","","1.54178","CuKα","","0.0284","0.0284","","","0.0747","0.0748","","","","","","1.042","","","","has coordinates","301831","2025-08-20","13:52:14",""
"4083278","15.2401","0.0005","30.2619","0.0012","15.5994","0.0006","90","","118.643","0.002","90","","6313.9","0.4","100","2","100","2","","","","","","","","9","P 1 21 1","P 2yb","4","","Compound [FBIP-CL]~2~","","- C115 H95 Cl25 Fe2 N8 O8 Pd2 Pt2 S4 -","- C115 H95 Cl25 Fe2 N8 O8 Pd2 Pt2 S4 -","- C230 H190 Cl50 Fe4 N16 O16 Pd4 Pt4 S8 -","2","1","","Weiss, Marcel; Frey, Wolfgang; Peters, René","Asymmetric Synthesis of Heterobimetallic Planar Chiral Ferrocene Pallada-/Platinacycles and Their Application to Enantioselective Aza-Claisen Rearrangements","Organometallics","2012","31","17","6365","","10.1021/om300600v","","","0.71073","MoKα","","0.0575","0.0492","","","0.1202","0.1231","","","","","","1.082","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083279","18.279","0.006","14.532","0.004","34.588","0.007","90","","103.87","0.02","90","","8920","4","293","2","293","2","","","","","","","","9","P 1 21 1","P 2yb","4","","compound 2","","- C86 H116 Cl4 Fe N6 O4 Pd Pt S2 -","- C86 H116 Cl4 Fe N6 O4 Pd Pt S2 -","- C344 H464 Cl16 Fe4 N24 O16 Pd4 Pt4 S8 -","4","2","","Weiss, Marcel; Frey, Wolfgang; Peters, René","Asymmetric Synthesis of Heterobimetallic Planar Chiral Ferrocene Pallada-/Platinacycles and Their Application to Enantioselective Aza-Claisen Rearrangements","Organometallics","2012","31","17","6365","","10.1021/om300600v","","","0.71073","MoKα","","0.2547","0.1334","","","0.2657","0.3097","","","","","","1.14","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083280","23.4813","0.0007","10.803","0.0005","34.7075","0.0009","90","","102.178","0.003","90","","8606.1","0.5","100","","100","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C159 H123 Cl37 Fe2 P8 Pt4 -","- C159 H123 Cl37 Fe2 P8 Pt4 -","- C318 H246 Cl74 Fe4 P16 Pt8 -","2","0.5","","Milde, Bianca; Packheiser, Rico; Hildebrandt, Stefanie; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Imidazole Phosphines: Synthesis, Reaction Chemistry, and Their Use in SuzukiC,CCross-Coupling Reactions","Organometallics","2012","31","9","3661","","10.1021/om300145d","","","1.54184","CuKα","","0.1617","0.0826","","","0.1819","0.2224","","","","","","0.943","","","","has coordinates,has disorder","178721","2020-10-21","18:00:00",""
"4083281","13.4466","0.0009","19.1778","0.001","12.0298","0.0011","90","","109.351","0.009","90","","2926.9","0.4","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H52 Cl4 N4 O4 P4 Pd2 -","- C62 H52 Cl4 N4 O4 P4 Pd2 -","- C124 H104 Cl8 N8 O8 P8 Pd4 -","2","0.5","","Milde, Bianca; Packheiser, Rico; Hildebrandt, Stefanie; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Imidazole Phosphines: Synthesis, Reaction Chemistry, and Their Use in SuzukiC,CCross-Coupling Reactions","Organometallics","2012","31","9","3661","","10.1021/om300145d","","","0.71073","MoKα","","0.1066","0.0375","","","0.0573","0.0627","","","","","","0.687","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4083282","40.6012","0.0007","10.5638","0.0003","28.5311","0.0006","90","","98.492","0.002","90","","12102.9","0.5","100","","100","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C149 H113 Cl3 Fe2 P8 Pt2 -","- C149 H113 Cl3 Fe2 P8 Pt2 -","- C596 H452 Cl12 Fe8 P32 Pt8 -","4","0.5","","Milde, Bianca; Packheiser, Rico; Hildebrandt, Stefanie; Schaarschmidt, Dieter; Rüffer, Tobias; Lang, Heinrich","Imidazole Phosphines: Synthesis, Reaction Chemistry, and Their Use in SuzukiC,CCross-Coupling Reactions","Organometallics","2012","31","9","3661","","10.1021/om300145d","","","1.54184","CuKα","","0.0727","0.0409","","","0.089","0.098","","","","","","0.884","","","","has coordinates","178721","2020-10-21","18:00:00",""
"4087348","8.0329","0.0003","19.9615","0.0007","26.0925","0.0009","90","","90","","90","","4183.9","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H23 N3 S2 Zr -","- C21 H23 N3 S2 Zr -","- C168 H184 N24 S16 Zr8 -","8","1","","Lenton, Taylor N.; VanderVelde, David G.; Bercaw, John E.","Synthesis of a Bis(thiophenolate)pyridine Ligand and Its Titanium, Zirconium, and Tantalum Complexes.","Organometallics","2012","31","","7492","7499","10.1021/om300789h","","","0.71073","MoKα","","0.0494","0.0318","","","0.049","0.0499","","","","","","2.099","","","","has coordinates","201975","2020-10-21","18:00:00",""
"4087349","23.134","0.0009","54.087","0.002","7.316","0.0003","90","","90","","90","","9154.1","0.6","100","2","100","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C23 H29 N4 S2 Ta -","- C23 H29 N4 S2 Ta -","- C368 H464 N64 S32 Ta16 -","16","1","","Lenton, Taylor N.; VanderVelde, David G.; Bercaw, John E.","Synthesis of a Bis(thiophenolate)pyridine Ligand and Its Titanium, Zirconium, and Tantalum Complexes.","Organometallics","2012","31","","7492","7499","10.1021/om300789h","","","0.71073","MoKα","","0.0186","0.0174","","","0.0356","0.0358","","","","","","1.107","","","","has coordinates","201976","2020-10-21","18:00:00",""
"4087350","28.2002","0.0012","13.4469","0.0006","14.703","0.0007","90","","101.852","0.002","90","","5456.6","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Cl N3 S2 Ta -","- C28 H34 Cl N3 S2 Ta -","- C224 H272 Cl8 N24 S16 Ta8 -","8","1","","Lenton, Taylor N.; VanderVelde, David G.; Bercaw, John E.","Synthesis of a Bis(thiophenolate)pyridine Ligand and Its Titanium, Zirconium, and Tantalum Complexes.","Organometallics","2012","31","","7492","7499","10.1021/om300789h","","","0.71073","MoKα","","0.0311","0.0193","","","0.0295","0.0302","","","","","","1.464","","","","has coordinates","201977","2020-10-21","18:00:00",""
"4089378","12.2671","0.0006","13.3398","0.0007","23.792","0.0017","98.582","0.002","94.212","0.002","117.175","0.001","3380.1","0.3","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","[L(tBu)Co(H)]2","","","- C76 H108 Co2 D6 N4 -","- C76 H114 Co2 N4 -","- C152 H228 Co4 N8 -","2","1","","Dugan, Thomas R.; Goldberg, Jonathan M.; Brennessel, William W.; Holland, Patrick L.","Low-Coordinate Cobalt Fluoride Complexes: Synthesis, Reactions, and Production from C‒F Activation Reactions","Organometallics","2012","31","4","1349","","10.1021/om200991k","","","0.71073","MoKα","","0.1096","0.0621","","","0.1348","0.1576","","","","","","1.031","","","","has coordinates,has disorder","243624","2020-10-21","18:00:00",""
"4089379","18.52","0.0011","16.6656","0.001","24.7602","0.0015","90","","90","","90","","7642.2","0.8","100","0.1","100","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","L(tBu)Co(n-hexyl)","","","- C41 H66 Co N2 -","- C41 H66 Co N2 -","- C328 H528 Co8 N16 -","8","1","","Dugan, Thomas R.; Goldberg, Jonathan M.; Brennessel, William W.; Holland, Patrick L.","Low-Coordinate Cobalt Fluoride Complexes: Synthesis, Reactions, and Production from C‒F Activation Reactions","Organometallics","2012","31","4","1349","","10.1021/om200991k","","","0.71073","MoKα","","0.112","0.0546","","","0.1175","0.1433","","","","","","1.007","","","","has coordinates","243624","2020-10-21","18:00:00",""
"4089380","27.432","0.002","9.535","0.0008","14.8903","0.0012","90","","117.789","0.001","90","","3445.6","0.5","213","2","213","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","unimc14","","","- C32 H34 F6 N2 O7 Ru2 S2 -","- C32 H34 F6 N2 O7 Ru2 S2 -","- C128 H136 F24 N8 O28 Ru8 S8 -","4","0.5","","Salembier, Hélori; Mauldin, Joshua; Hammond, Tom; Wallace, Rodney; Alqassab, Essa; Hall, Michael B.; Pérez, Lisa M.; Chen, Yuen-Jing Alexis; Turner, Katherine E.; Bockoven, Eric; Brennessel, William; Chin, Robert M.","Diruthenium Naphthalene and Anthracene Complexes Containing a Doubly Linked Dicyclopentadienyl Ligand","Organometallics","2012","31","13","4838","","10.1021/om300384d","","","0.71073","MoKα","","0.0725","0.0459","","","0.1162","0.1283","","","","","","1.046","","","","has coordinates,has disorder","243625","2020-10-21","18:00:00",""
"4089381","8.0897","0.0009","16.2936","0.0018","15.149","0.0017","90","","101.714","0.002","90","","1955.2","0.4","100","0.1","100","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","unimc16","","","- C26 H26 Ru2 -","- C26 H26 Ru2 -","- C104 H104 Ru8 -","4","1","","Salembier, Hélori; Mauldin, Joshua; Hammond, Tom; Wallace, Rodney; Alqassab, Essa; Hall, Michael B.; Pérez, Lisa M.; Chen, Yuen-Jing Alexis; Turner, Katherine E.; Bockoven, Eric; Brennessel, William; Chin, Robert M.","Diruthenium Naphthalene and Anthracene Complexes Containing a Doubly Linked Dicyclopentadienyl Ligand","Organometallics","2012","31","13","4838","","10.1021/om300384d","","","0.71073","MoKα","","0.0489","0.0312","","","0.0623","0.068","","","","","","1.018","","","","has coordinates","243625","2020-10-21","18:00:00",""
"4089382","12.721","0.002","15.09","0.003","18.288","0.004","93.529","0.004","90.48","0.003","106.934","0.004","3350.7","1.1","100","0.1","100","0.1","","","","","","","","7","P -1","-P 1","2","unimc10","","","- C68 H64 F12 N2 O13 Ru4 S4 -","- C68 H64 F12 N2 O13 Ru4 S4 -","- C136 H128 F24 N4 O26 Ru8 S8 -","2","1","","Salembier, Hélori; Mauldin, Joshua; Hammond, Tom; Wallace, Rodney; Alqassab, Essa; Hall, Michael B.; Pérez, Lisa M.; Chen, Yuen-Jing Alexis; Turner, Katherine E.; Bockoven, Eric; Brennessel, William; Chin, Robert M.","Diruthenium Naphthalene and Anthracene Complexes Containing a Doubly Linked Dicyclopentadienyl Ligand","Organometallics","2012","31","13","4838","","10.1021/om300384d","","","0.71073","MoKα","","0.0699","0.0545","","","0.1326","0.1398","","","","","","1.068","","","","has coordinates","243625","2020-10-21","18:00:00",""
"4101151","10.648","0.001","11.76","0.001","13.755","0.002","67.66","0.01","73.6","0.01","87.29","0.01","1524.81","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C32.5 H40 B N O7 -","- C34 H35 B N O7 -","- C68 H70 B2 N2 O14 -","2","1","","Reetz, Manfred T.; Niemeyer, Christof M.; Hermes, Marcus; Goddard, Richard","Molecular Recognition of Primary Amines by Three-Point Binding with Boron-Containing Host Molecules","Angewandte Chemie, International Edition in English","1992","31","8","1017","1019","10.1002/anie.199210171","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4331436","6.849","","5","","12.718","","90","","92.53","","90","","435.103","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","Rb Zn4 (B O3)3","","- B3 O9 Rb Zn4 -","- B3 O9 Rb Zn4 -","- B6 O18 Rb2 Zn8 -","2","0.5","","Keszler, D.A.; Luce, J.L.; Smith, R.W.","Framework alkali metal zinc orthoborates: A Zn4 (B O3)3 (A = K, Rb, Cs)","Inorganic Chemistry","1992","31","","4679","4682","10.1021/ic00048a042","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4344366","6.547","","6.547","","6.547","","90","","90","","90","","280.625","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Na2 S -","- Na2 S -","- Na8 S4 -","4","0.0208333","","Bonneau, P.R.; Jarvis, R.F.jr.; Kaner, R.B.","Solid-state metathesis as a quick route to transition- metal mixed dichalcogenides","Inorganic Chemistry","1992","31","","2127","2132","","","","","","","","","","","","","","","","","","","","","","has coordinates","301840","2025-08-20","23:44:59",""
"4344367","7.3","","7.3","","7.3","","90","","90","","90","","389.017","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Na2 Te -","- Na2 Te -","- Na8 Te4 -","4","0.0208333","","Bonneau, P.R.; Jarvis, R.F.jr.; Kaner, R.B.","Solid-state metathesis as a quick route to transition- metal mixed dichalcogenides","Inorganic Chemistry","1992","31","","2127","2132","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4345023","9.1305","0.0001","9.1305","0.0001","8.1318","0.0002","90","","90","","90","","677.92","0.02","","","292","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- As2 H4 O9 V -","- As2 H8 O9 V -","- As8 H32 O36 V4 -","4","0.125","","Aranda, Miguel A. G.; Attfield, J. Paul; Bruque, Sebastian; Martinez-Lara, Maria","Order and disorder of vanadyl chains: crystal structures of Vanadyl difydrogen arsenate (VO(H2AsO4)2) and the lithium derivative Li4VO(AsO4)2","Inorganic Chemistry","1992","31","","1045","1049","10.1021/ic00032a023","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.055","","","","","","","","","has coordinates","190436","2020-10-21","18:00:00",""
"4345024","9.0293","0.0002","9.0293","0.0002","9.0053","0.0004","90","","90","","90","","734.19","0.04","","","292","","","","","","","","","4","P 4/n c c :2","-P 4a 2ac","130","","","","- As2 Li4 O9 V -","- As2 Li4 O9 V1.004 -","- As8 Li16 O36 V4.016 -","4","0.25","","Aranda, Miguel A. G.; Attfield, J. Paul; Bruque, Sebastian; Martinez-Lara, Maria","Order and disorder of vanadyl chains: crystal structures of Vanadyl difydrogen arsenate (VO(H2AsO4)2) and the lithium derivative Li4VO(AsO4)2","Inorganic Chemistry","1992","31","","1045","1049","10.1021/ic00032a023","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.093","","","","","","","","","has coordinates","190437","2020-10-21","18:00:00",""
"4345038","7.531","0.002","15.522","0.004","9.149","0.002","90","","113.52","0.02","90","","980.6","0.4","","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ca2 H4 O13 P3 V -","- Ca2 H4 O13 P3 V -","- Ca8 H16 O52 P12 V4 -","4","0.5","","Lii, K. H.; Wen, N. S.; Su, C. C.; Chueh, B. R.","Hydrothermal synthesis and structural characterization of two calcium vanadium(III) phosphates: Ca2V(PO4)(HPO4)2.H2O and Ca2V(PO4)(P2O7)","Inorganic Chemistry","1992","31","","439","442","10.1021/ic00029a017","","x-ray","0.71073","MoKα","","","0.0215","","","0.0206","","","","","","","","","","","has coordinates","190557","2020-10-21","18:00:00",""
"4345039","6.391","0.002","6.6362","0.0009","19.071","0.002","90","","99.26","0.02","90","","798.3","0.3","","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ca2 O11 P3 V -","- Ca2 O11 P3 V -","- Ca8 O44 P12 V4 -","4","1","","Lii, K. H.; Wen, N. S.; Su, C. C.; Chueh, B. R.","Hydrothermal synthesis and structural characterization of two calcium vanadium(III) phosphates: Ca2V(PO4)(HPO4)2.H2O and Ca2V(PO4)(P2O7)","Inorganic Chemistry","1992","31","","439","442","10.1021/ic00029a017","","x-ray","0.7093","MoKα","","","0.029","","","0.034","","","","","","","","","","","has coordinates","190558","2020-10-21","18:00:00",""
"4513546","9.0317","0.0006","11.6572","0.0009","13.7558","0.0012","99.386","0.003","101.188","0.003","102.814","0.003","1352.82","0.18","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H33 B F2 I2 N2 O -","- C27 H33 B F2 I2 N2 O -","- C54 H66 B2 F4 I4 N4 O2 -","2","1","","Bell, Nia C.; Doyle, Samantha J.; Battistelli, Giulia; LeGuyader, Clare L. M.; Thompson, Matthew P.; Poe, Ambata M.; Rheingold, Arnold; Moore, Curtis; Montalti, Marco; Thayumanavan, S.; Tauber, Michael J.; Gianneschi, Nathan C.","Dye Encapsulation in Polynorbornene Micelles.","Langmuir : the ACS journal of surfaces and colloids","2015","31","35","9707","9717","10.1021/acs.langmuir.5b01822","","x-ray","0.71073","MoKα","","0.0346","0.0278","","","0.0676","0.0742","","","","","","1.053","","","","has coordinates,has disorder","301843","2025-08-21","01:58:40",""
"4513732","14.3719","0.0008","11.6958","0.0005","14.695","0.003","90","","94.89","0.008","90","","2461.1","0.5","100.3","","100.3","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C45 H85 N3 O15 -","- C45 H85 N3 O15 -","- C90 H170 N6 O30 -","2","1","","Liang, Zuozhong; Wang, Yuan; Wang, Wei; Han, Xianglong; Chen, Jian-Feng; Xue, Chunyu; Zhao, Hong","Structural Correspondence of the Oriented Attachment Growth Mechanism of Crystals of the Pharmaceutical Dirithromycin.","Langmuir : the ACS journal of surfaces and colloids","2015","31","51","13802","13812","10.1021/acs.langmuir.5b02901","","","0.7107","MoKα","","0.06","0.051","","","0.1134","0.1201","","","","","","1.019","","","","has coordinates","301843","2025-08-21","01:58:42",""
"5000013","27.763","0.017","7.059","0.004","5.38","0.005","90","","90","","90","","1054.37","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 Cl N O2 -","- C9 H12 Cl N O2 -","- C36 H48 Cl4 N4 O8 -","4","1","","Al-Karaghouli, A. R.; Koetzle, T. F.","Neutron diffraction study of L-phenylalanine hydrochloride","Acta Crystallographica Section B","1975","31","10","2461","2465","10.1107/S0567740875007807","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:29",""
"5000022","11.159","0.002","14.461","0.002","4.821","0.001","90","","101.15","0.02","90","","763.28","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H18 N2 O10 -","- C12 H13 N2 O10 -","- C24 H26 N4 O20 -","2","1","","Morikawa, K.; Torii, K.; Iitaka, Y.; Tsuboi, M.","Uridine-5-oxyacetic acid methyl ester monohydrate","Acta Crystallographica Section B","1975","31","4","1004","1007","10.1107/S0567740875004384","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"5000024","13.372","0.002","10.497","0.003","11.992","0.002","90","","90","","90","","1683.27","","","","","","","","","","","","","2","P b c n","-P 2n 2ab","60","","","","- C12 Cl10 -","- C24 Cl20 -","- C96 Cl80 -","4","0.5","","Pedersen, B.","Decachlorobiphenyl, C~12~Cl~10~: the crystal and molecular structure","Acta Crystallographica Section B","1975","31","12","2931","2933","10.1107/S0567740875009314","","","","","","","","","","","","","","","","","","","","","has coordinates","175309","2020-10-21","18:00:00",""
"5000102","8.743","0.002","13.364","0.003","13.147","0.003","90","","108.66","0.01","90","","1455.37","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 N O3 -","- C17 H19 N O3 -","- C68 H76 N4 O12 -","4","1","","Grynpas, M.; Lindley, P. F.","The crystal and molecular structure of 1-piperoylpiperidine","Acta Crystallographica Section B","1975","31","11","2663","2667","10.1107/S0567740875008412","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:30",""
"5000128","10.457","0.002","10.387","0.002","32.345","0.006","90","","90","","90","","3513.21","","","","","","","","","","","","","6","P c a b","-P 2bc 2ac","61","","","","- C17 H19 Cl F3 N O -","- C17 H19 Cl F3 N O -","- C136 H152 Cl8 F24 N8 O8 -","8","1","","Robertson, David W.; Jones, Noel D.; Swartzendruber, John K.; Yang, Kuo S.; Wong, David T.","Molecular structure of fluoxetine hydrochloride, a highly selective serotonin-uptake inhibitor","Journal of Medicinal Chemistry","1988","31","1","185","189","10.1021/jm00396a030","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:30",""
"5000154","13.29","","13.49","","6.83","","90","","90","","90","","1224.5","","","","","","","","","","","","","4","P c n b","-P 2b 2ac","60","","","","- C5 H8 N4 O12 -","- C9 H16 N8 O24 -","- C36 H64 N32 O96 -","4","0.5","","Cady, H. H.; Larson, A. C.","Pentaerythritol tetranitrate II: its crystal structure and transformation to PETN I; an algorithm for refinement of crystal structures with poor data","Acta Crystallographica Section B","1975","31","7","1864","1869","10.1107/S0567740875006383","","","","","","","","","","","","","","","","","","","","","has coordinates","175351","2020-10-21","18:00:00",""
"5000169","19.28","0.02","7.78","0.01","9.57","0.01","90","","112.39","0.1","90","","1327.27","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H11 N O -","- C6 H11 N O -","- C48 H88 N8 O8 -","8","1","","Winkler, F. K.; Dunitz, J. D.","Medium-ring compounds. XIX. Caprolactam: structure refinement","Acta Crystallographica Section B","1975","31","1","268","269","10.1107/S0567740875002440","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:30",""
"5000217","2.8608","0.0004","2.8608","0.0004","2.8608","0.0004","90","","90","","90","","23.4","","","","","","","","","","","","","1","I m -3 m","-I 4 2 3","229","Iron","Iron","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Owen, E A; Williams, G I","A low-temperature X-ray camera","Journal of Scientific Instruments","1954","31","","49","54","10.1088/0950-7671/31/2/305","","","","","","","","","","","","","","","","","","","","","has coordinates","202022","2020-10-21","18:00:00",""
"5000263","12.345","0.003","12.738","","13.315","0.005","90","","90","","90","","2093.79","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H32 N2 O -","- C22 N2 O -","- C88 N8 O4 -","4","1","","Fusetani, N.; Yasumuro, K.; Kawai, H.; Natori, T.; Brinen, L.; Clardy, J.","Kalihinene and isokalihinol B, cytotoxic diterpene isonitriles from the marine sponge Acanthella klethra","Tetrahedron Letters","1990","31","25","3599","3602","10.1016/S0040-4039(00)94453-8","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"6000386","8.35929","0.00003","5.35083","0.00002","6.86939","0.00003","90","","90","","90","","307.24","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Strontium Sulfate","Celestine","- O4 S Sr -","- O16 S4 Sr4 -","- O16 S4 Sr4 -","","","","Burger, K.; Cox, D.; Papoular, R.; Prandl, W.","The application of resonant scattering techniques to ab initio structure solution from powder data using SrSO4 as a test case","Journal of Applied Crystallography","1998","31","","789","797","10.1107/S0021889898006293","","","","","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"6000685","13.5238","0.0003","5.5285","0.0001","9.1886","0.0002","90","","96.171","0.001","90","","683.02","0.02","","","293","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- Bi7 F11 O5 -","- Bi7 F11 O5 -","- Bi14 F22 O10 -","2","0.5","","Laval, J.-P.; Champarnaud-Mesjard, J.-C.; Frit, B.; Britel, A.; Mikou, A.","BI7F11O5 - a new ordered anion-excess fluorite-related structure with columnar clusters","European Journal of Solid State and Inorganic Chemistry","1994","31","","943","956","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.033","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000716","14.493","","14.493","","9.317","","90","","90","","90","","1957.01","","","","","","","","","","","","","3","I 41/a m d","","","","","","- Bi2 Cd O4 -","","","","","","Champarnaudmesjard, J. C.; Frit, B.; Aftati, A.; Elfarissi, M.","Crystal-structure of Bi2CdO4","European Journal of Solid State and Inorganic Chemistry","1994","31","","473","486","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7052040","18.795","0.0009","18.795","0.0009","29.9286","0.0019","90","","90","","90","","10572.3","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C368 H720 Ce8 Cl16 N32 Na8 -","16","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0628","0.0333","","","0.0715","0.0798","","","","","","0.914","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052041","12.6251","0.0013","15.995","0.0013","24.079","0.004","90","","100.451","0.016","90","","4781.8","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H78 Cl2 Na O4 Sm -","- C42 H78 Cl2 Na O4 Sm -","- C168 H312 Cl8 Na4 O16 Sm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0787","0.0373","","","0.0656","0.0735","","","","","","0.82","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052042","12.6235","0.0007","18.0143","0.001","35.025","0.003","90","","90","","90","","7964.8","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H67 Al Cl Nd -","- C37 H67 Al Cl Nd -","- C296 H536 Al8 Cl8 Nd8 -","8","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0686","0.0411","","","0.0955","0.1048","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052043","13.2826","0.0008","11.7557","0.0005","34.576","0.003","90","","97.344","0.008","90","","5354.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H45 Cl2 O2 Yb -","- C25 H45 Cl2 O2 Yb -","- C200 H360 Cl16 O16 Yb8 -","8","2","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0536","0.04","","","0.0789","0.0825","","","","","","0.984","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052044","16.2836","0.0011","16.2836","0.0011","16.2836","0.0011","109.604","0.007","109.604","0.007","109.604","0.007","3307.3","0.6","293","2","293","2","","","","","","","","5","R -3 :R","-P 3*","148","","","","- C40 H72 Cl2 O4 Yb2 -","- C40 H72 Cl2 O4 Yb2 -","- C120 H216 Cl6 O12 Yb6 -","3","0.5","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0483","0.0422","","","0.0842","0.0871","","","","","","1.114","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052045","11.7891","0.0006","15.4829","0.0008","18.5865","0.001","90","","95.586","0.006","90","","3376.5","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H58 I Tm -","- C34 H58 I Tm -","- C136 H232 I4 Tm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.038","0.0244","","","0.0483","0.0502","","","","","","0.885","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052046","8.8947","0.0006","13.8338","0.0007","10.3037","0.0008","90","","105.603","0.008","90","","1221.12","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H39 Cl2 O2 Tm -","- C21 H39 Cl2 O2 Tm -","- C42 H78 Cl4 O4 Tm2 -","2","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0569","0.0367","","","0.0702","0.0745","","","","","","0.901","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052047","16.33","0.06","11.47","0.07","21.45","0.06","90","","103.8","0.2","90","","3902","3","298","2","298","2","","","","","","","Synthesis","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 Mo8 N4 O26 -","- C24 H28 Mo8 N4 O26 -","- C96 H112 Mo32 N16 O104 -","4","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0617","0.0452","","","0.1153","0.128","","","","","","1.138","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052048","10.716","0.002","11.128","0.002","11.666","0.002","68.08","0.03","85.5","0.03","76.19","0.03","1253.2","0.5","298","2","298","2","","","","","","","Synthesis","5","P -1","-P 1","2","","","","- C18 H20 Mo4 N3 O13 -","- C18 H20 Mo4 N3 O13 -","- C36 H40 Mo8 N6 O26 -","2","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0444","0.0351","","","0.0867","0.0918","","","","","","1.042","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052049","11.581","0.003","17.146","0.007","12.875","0.003","90","","101.447","0.016","90","","2505.7","1.4","298","2","298","2","","","","","","","Synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Mo8 N6 O26 -","- C36 H40 Mo8 N6 O26 -","- C72 H80 Mo16 N12 O52 -","2","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.082","0.0426","","","0.088","0.103","","","","","","1.041","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052050","9.6894","0.0017","13.447","0.003","15.341","0.002","90","","100.614","0.013","90","","1964.6","0.6","273","2","273","2","","","","","","","Synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Mo4 N2 O13 -","- C12 H14 Mo4 N2 O13 -","- C48 H56 Mo16 N8 O52 -","4","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.051","0.0382","","","0.0939","0.1009","","","","","","1.067","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052051","9.432","0.001","27.584","0.002","9.901","0.001","90","","114.26","0.01","90","","2348.5","0.4","208","2","208","2","","","","","","","","3","C 1 c 1","C -2yc","9","Cryptant-S6-Me2","Cryptant-S6-Me2","","- C19 H36 S6 -","- C19 H36 S6 -","- C76 H144 S24 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0957","0.0754","","","0.1989","0.2235","","","","","","0.931","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052052","10.396","0.001","15.421","0.002","18.421","0.005","90","","90","","90","","2953.2","0.9","208","2","208","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","S6-Ethylenecagesilver(i) trifluoromethylsulfonate","S6-Ethylenecagesilver(I) trifluoromethylsulfonate","","- C21 H38 Ag F3 O3 S7 -","- C21 H38 Ag F3 O3 S7 -","- C84 H152 Ag4 F12 O12 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.141","0.0675","","","0.1353","0.1668","","","","","","1.029","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052053","21.614","0.008","13.491","0.002","18.364","0.008","90","","109.7","0.02","90","","5041","3","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Ag2(3-S6-cage-3-NO2)(triflat)2] x 2 AN","","","- C35 H60 Ag2 F6 N4 O10 S8 -","- C35 H60 Ag2 F6 N4 O10 S8 -","- C140 H240 Ag8 F24 N16 O40 S32 -","4","0.5","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.1007","0.0476","","","0.1055","0.1235","","","","","","1.005","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052054","18.186","0.004","26.587","0.004","10.255","0.002","90","","101.16","0.01","90","","4864.6","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-S6-Hydroxy cage","","- C19 H36 O S6 -","- C19 H36 O S6 -","- C152 H288 O8 S48 -","8","2","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0899","0.0552","","","0.1378","0.1604","","","","","","0.997","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052055","10.707","0.004","17.737","0.004","19.081","0.008","90","","103.61","0.02","90","","3522","2","208","2","208","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(S6-Cage-C4-OH-CH3)(tosylato)silver(I)] polymer","","- C29 H49 Ag O4 S7 -","- C29 H49 Ag O4 S7 -","- C116 H196 Ag4 O16 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.3303","0.0776","","","0.0755","0.1173","","","","","","0.956","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052056","19.785","0.001","11.7253","0.0004","19.6134","0.0007","90","","90","","90","","4550","0.3","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C38 H78 N4 O7 Ti2 -","- C38 H78 N4 O7 Ti2 -","- C152 H312 N16 O28 Ti8 -","4","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1033","0.0607","","","0.1248","0.141","","","","","","1.008","","","","has coordinates,has disorder","301851","2025-08-21","20:32:39",""
"7052057","10.762","0.002","12.115","0.002","15.963","0.003","76.68","0.03","72.59","0.03","68.58","0.03","1831.5","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H68 N4 O4 Zr -","- C32 H68 N4 O4 Zr -","- C64 H136 N8 O8 Zr2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.0458","0.0373","","","0.0851","0.0886","","","","","","1.032","","","","has coordinates,has disorder","301851","2025-08-21","20:32:39",""
"7052058","11.019","0.0005","14.3144","0.0006","15.7604","0.0008","70.24","0.003","88.145","0.002","71.787","0.002","2214.83","0.18","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H76 N2 O8 Ti2 -","- C35 H76 N2 O8 Ti2 -","- C70 H152 N4 O16 Ti4 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1451","0.0684","","","0.1524","0.1758","","","","","","1.002","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052059","8.83","0.005","9.726","0.005","17.047","0.005","93.801","0.005","98.098","0.005","112.844","0.005","1323.9","1.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H48 N2 O4 Ti -","- C22 H48 N2 O4 Ti -","- C44 H96 N4 O8 Ti2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71069","MoKα","","0.0538","0.0416","","","0.0881","0.0932","","","","","","1.03","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052060","15.2741","0.0008","23.8114","0.0011","21.7021","0.0014","90","","91.297","0.002","90","","7891","0.8","173","0.1","173","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H107.5 Cl0.5 N O32 -","- C76 H107.5 Cl0.5 N O32 -","- C304 H430 Cl2 N4 O128 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.2813","0.1489","","","0.2742","0.3258","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052061","13.9176","0.0007","15.1093","0.0009","18.6526","0.001","90","","109.008","0.003","90","","3708.5","0.4","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H50 Cl N O14 -","- C37 H50 Cl N O14 -","- C148 H200 Cl4 N4 O56 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1739","0.0837","","","0.1243","0.1549","","","","","","1.095","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052062","21.2275","0.0011","25.3429","0.0013","17.9561","0.0005","90","","122.883","0.002","90","","8112.1","0.7","173","0.1","173","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H58 Cl N O14 -","- C41 H58 Cl N O14 -","- C328 H464 Cl8 N8 O112 -","8","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.153","0.1021","","","0.2296","0.2541","","","","","","1.111","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052063","28.6719","0.0006","14.5214","0.0005","20.4197","0.0006","90","","131.685","0.002","90","","6349.3","0.4","173","0.1","173","0.1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C70 H82 O27 -","- C70 H82 O27 -","- C280 H328 O108 -","4","0.5","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1509","0.0942","","","0.2198","0.2677","","","","","","1.111","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052064","33.824","0.008","10.759","0.003","23.446","0.006","90","","100.613","0.004","90","","8386","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H33.5 Br2 Cl10.5 N4 Ni -","- C32.5 H33 Br2 Cl9.75 N4 Ni -","- C260 H264 Br16 Cl78 N32 Ni8 -","8","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.2232","0.1088","","","0.2653","0.325","","","","","","0.893","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052065","10.3842","0.0007","16.8912","0.0011","17.4972","0.0012","90","","96.166","0.001","90","","3051.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 Cl5 N4 Zn -","- C29 H29 Cl5 N4 Zn -","- C116 H116 Cl20 N16 Zn4 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0471","0.0367","","","0.0884","0.0919","","","","","","0.974","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052066","10.0666","0.0012","17.26","0.002","16.987","0.002","90","","96.542","0.002","90","","2932.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Fe N5 -","- C30 H31 Cl2 Fe N5 -","- C120 H124 Cl8 Fe4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0497","0.0408","","","0.1039","0.1089","","","","","","1.045","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052067","10.089","0.003","17.124","0.005","16.991","0.005","90","","96.459","0.005","90","","2916.8","1.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Co N5 -","- C30 H31 Cl2 Co N5 -","- C120 H124 Cl8 Co4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0409","0.0336","","","0.092","0.0947","","","","","","1.036","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052068","10.2739","0.0019","10.5553","0.0019","12.623","0.002","94.301","0.003","101.922","0.003","96.325","0.003","1324.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H30 Cl2 N4 Zn -","- C29 H30 Cl2 N4 Zn -","- C58 H60 Cl4 N8 Zn2 -","2","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0567","0.044","","","0.1004","0.1055","","","","","","1.003","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052069","16.936","0.003","15.203","0.003","21.457","0.004","90","","90","","90","","5524.7","1.8","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C52 H58 Cl2 Fe4 N8 O18 -","- C52 H58 Cl2 Fe4 N8 O18 -","- C208 H232 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.2755","0.0583","","","0.0876","0.1355","","","","","","0.733","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052070","21.958","0.004","15.182","0.003","19.591","0.004","90","","91.61","0.02","90","","6528","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H62 Cl2 Fe4 N8 O18 -","- C62 H62 Cl2 Fe4 N8 O18 -","- C248 H248 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.1307","0.0597","","","0.1212","0.1511","","","","","","1.012","","","","has coordinates,has disorder","301851","2025-08-21","20:32:39",""
"7052071","7.8781","0.0002","12.7652","0.0003","12.8795","0.0003","91.972","0.005","102.869","0.005","92.2","0.005","1260.54","0.06","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C31 H32 O5 -","- C31 H32 O5 -","- C62 H64 O10 -","2","1","","Sergio Andrés Pérez Guarìn; Derek Tsang; W. G. Skene","Spectroscopic studies of a fluorescent fluoresceinophane formed via a practical synthetic route","New Journal of Chemistry","2007","31","2","210","","10.1039/b611060f","","","0.71073","Mo-Kα","","0.12","0.047","","0.232","","0.064","","","3.963","","","1.083","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052072","7.2136","0.0009","7.6191","0.0008","8.101","0.0011","102.96","0.01","106.797","0.01","111.387","0.009","368.76","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3-Fluoro-2-formyl-phenylboronic acid","3-Fluoro-2-formyl-phenylboronic acid","","- C7 H6 B F O3 -","- C7 H6 B F O3 -","- C14 H12 B2 F2 O6 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.037","0.0327","","","0.0874","0.0907","","","","","","1.066","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052073","7.0559","0.0016","8.3747","0.0018","9.656","0.002","89.986","0.017","99.607","0.018","108.329","0.017","533.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","","- C7 H7 B Br2 O4 -","- C7 H7 B Br2 O4 -","- C14 H14 B2 Br4 O8 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0327","0.0253","","","0.0622","0.0652","","","","","","1.05","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052074","11.159","0.003","11.116","0.002","29.383","0.007","90","","94.473","0.018","90","","3633.7","1.5","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1,3-Dihydro-1,3-dihydroxy-4-bromo-2,1-benzoxaborole monohydrate","","- C7 H8 B Br O4 -","- C7 H6 B Br O4 -","- C112 H96 B16 Br16 O64 -","16","4","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0809","0.0593","","","0.1481","0.1617","","","","","","1.04","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052075","7.0108","0.0002","11.0338","0.0003","16.912","0.0004","93.637","0.001","95.736","0.001","95.729","0.001","1291.62","0.06","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H18 Ag F6 N3 O3 Sb -","- C24 H18 Ag F6 N3 O3 Sb -","- C48 H36 Ag2 F12 N6 O6 Sb2 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0286","0.022","","","0.0542","0.057","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052076","9.123","0.0006","11.624","0.0006","12.477","0.0009","62.419","0.002","83.793","0.002","83.386","0.005","1162.71","0.13","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H20 Ag As F6 N2 O4 -","- C20 H12 Ag As F6 N2 O4 -","- C40 H24 Ag2 As2 F12 N4 O8 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1316","0.0658","","","0.1597","0.1903","","","","","","1.054","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052077","11.768","0.0002","25.757","0.0006","8.587","0.0004","90","","96.92","0.0009","90","","2583.83","0.14","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag As F6 N2 O5 -","- C22 H24 Ag As F6 N2 O5 -","- C88 H96 Ag4 As4 F24 N8 O20 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1806","0.0508","","","0.0709","0.092","","","","","","0.975","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052078","11.964","0.0001","25.717","0.0004","8.632","0.0002","90","","97.078","0.0006","90","","2635.64","0.08","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag F6 N2 O5 Sb -","- C22 H24 Ag F6 N2 O5 Sb -","- C88 H96 Ag4 F24 N8 O20 Sb4 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0874","0.0464","","","0.1151","0.1321","","","","","","1.035","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052079","6.6026","0.0001","12.932","0.0002","15.1197","0.0003","90","","102.109","0.0009","90","","1262.27","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O -","- C13 H17 N3 O -","- C52 H68 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0491","0.0421","","","0.1146","0.1211","","","","","","1.07","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052080","10.2904","0.0002","8.7167","0.0002","14.0155","0.0003","90","","100.932","0.0009","90","","1234.36","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C48 H56 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0466","0.0396","","","0.1107","0.1169","","","","","","1.078","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052081","6.9786","0.0002","14.2655","0.0005","13.2947","0.0006","90","","101.364","0.001","90","","1297.58","0.08","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O2 -","- C13 H17 N3 O2 -","- C52 H68 N12 O8 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0625","0.0454","","","0.1151","0.1256","","","","","","1.028","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052082","8.1028","0.0002","10.4312","0.0002","10.4731","0.0002","67.932","0.001","76.578","0.001","71.72","0.001","772.36","0.03","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C36 H38 N6 O2 -","2","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0555","0.0432","","","0.1144","0.1242","","","","","","1.052","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052083","7.7167","0.0001","10.8913","0.0001","18.8973","0.0003","90","","90","","90","","1588.22","0.04","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C72 H76 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0421","0.0368","","","0.0894","0.0932","","","","","","1.022","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052084","8.0995","0.0001","9.5542","0.0002","20.4491","0.0004","90","","98.2804","0.0008","90","","1565.94","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N4 O3 -","- C17 H16 N4 O3 -","- C68 H64 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0747","0.0493","","","0.1141","0.1316","","","","","","1.037","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052085","13.6403","0.0002","9.6489","0.0002","24.3685","0.0005","90","","90","","90","","3207.23","0.1","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C144 H152 N24 O16 -","8","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0533","0.0391","","","0.0952","0.1026","","","","","","1.038","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052086","8.6915","0.0002","17.1912","0.0004","13.2188","0.0003","90","","101.066","0.001","90","","1938.39","0.08","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0674","0.0519","","","0.1335","0.1487","","","","","","1.014","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052087","8.5205","0.0002","12.6244","0.0003","18.1441","0.0004","90","","90","","90","","1951.69","0.08","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0605","0.044","","","0.1106","0.1213","","","","","","1.019","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052088","8.3729","0.0006","14.6999","0.001","9.1764","0.0006","90","","98.917","0.002","90","","1115.79","0.13","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C48 H40 N16 O8 -","4","1","","Tzeng, Biing-Chiau; Chen, Yen-Fei; Wu, Chia-Chin; Hu, Cho-Chun; Chang, Ya-Ting; Chen, Chang-Kai","Anion-recognition studies of a Re(i)-based square containing the dipyridyl-amide ligand","New Journal of Chemistry","2007","31","2","202","","10.1039/b613508k","","","0.71073","MoKα","","0.0618","0.0487","","","0.1121","0.1193","","","","","","1.068","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052089","6.2667","0.0009","8.5979","0.0012","19.959","0.003","83.907","0.002","89.471","0.002","77.551","0.002","1044.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H26 O2 -","- C27 H26 O2 -","- C54 H52 O4 -","2","1","","Han, Jie; Li, Yan-Xia; Pang, Mei-Li; Cheng, Kai-Ge; Wang, Yan-Mei; Ma, Yu-Xin; Meng, Ji-Ben","A novel photochromic liquid crystal system based on biindenylidenedione derivatives","New Journal of Chemistry","2007","31","4","543","","10.1039/b613549h","","","0.71073","MoKα","","0.1149","0.0529","","","0.1342","0.1626","","","","","","1.019","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052090","32.142","0.006","6.2276","0.0012","11.413","0.002","90","","101.7","0.03","90","","2237","0.8","150","2","150","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C29 H26 O3 -","- C29 H26 O3 -","- C116 H104 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1474","0.0876","","","0.1387","0.1579","","","","","","1.068","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052091","6.001","0.0012","18.79","0.004","20.595","0.004","90","","90","","90","","2322.3","0.8","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H28 O3 -","- C30 H28 O3 -","- C120 H112 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0698","0.05","","","0.0901","0.096","","","","","","1.086","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052092","20.793","0.004","6.122","0.0012","20.961","0.004","90","","114.24","0.03","90","","2433","1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 O3 -","- C31 H30 O3 -","- C124 H120 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1077","0.0554","","","0.1081","0.1247","","","","","","1.014","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052093","5.7983","0.0012","9.0444","0.0018","15.82","0.003","94.69","0.03","100","0.03","106.81","0.03","774.4","0.3","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H18 O -","- C21 H18 O -","- C42 H36 O2 -","2","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0907","0.0594","","","0.128","0.1413","","","","","","1.068","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052094","9.0898","0.0018","19.066","0.004","20.516","0.004","90","","95.84","0.03","90","","3537.1","1.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Ga3 I5 O4 -","- C28 H20 Ga3 I5 O4 -","- C112 H80 Ga12 I20 O16 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0607","0.0399","","","0.0878","0.0955","","","","","","1.049","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052095","7.4458","0.0015","18.197","0.004","12.271","0.003","90","","94.13","0.03","90","","1658.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 Ga I3 O2 -","- C11 H12 Ga I3 O2 -","- C44 H48 Ga4 I12 O8 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0852","0.0533","","","0.1217","0.1356","","","","","","1.021","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052096","12.2707","0.0013","13.5989","0.0015","15.4906","0.0017","71.1","0.002","73.3","0.002","72.169","0.002","2276.7","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H46 N6 O6 -","- C56 H46 N6 O6 -","- C112 H92 N12 O12 -","2","1","","Anas, S.; Krishnan, K. Syam; Sajisha, V. Sanjayan; Anju, K. Sasidharan; Radhakrishnan, K. V.; Suresh, Eringathodi; Suresh, Cherumuttathu H.","Interplay of dual reactivity in the reaction of pentafulvenes with 1,2,4-triazoline-3,5-diones: experimental and theoretical investigations","New Journal of Chemistry","2007","31","2","237","","10.1039/b614533g","","","0.71073","MoKα","","0.1444","0.0738","","","0.1924","0.235","","","","","","1.025","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052097","9.75","0.002","10.216","0.002","11.647","0.002","64.72","0.03","84.92","0.03","76.29","0.03","1019","0.4","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","1","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.029","","0.035","","0.033","","","1.013","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052098","7.6971","0.0015","34.283","0.007","8.5201","0.0017","90","","111.43","0.03","90","","2092.8","0.8","123","","123","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Ho2 O34 S6 -","- C18 H44 Ho2 O34 S6 -","- C36 H88 Ho4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.031","0.023","","0.15","","0.035","","","1.451","","","1.056","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052099","7.6711","0.0005","34.174","0.002","8.5082","0.0005","90","","111.555","0.001","90","","2074.5","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Yb2 -","- C18 H44 O34 S6 Yb2 -","- C36 H88 O68 S12 Yb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.036","","0.065","","0.065","","","0.987","","","1.009","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052100","7.256","0.0005","12.7526","0.0008","19.514","0.001","90","","90","","90","","1805.69","0.19","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H20 Cl La O14 S2 -","- C6 H20 Cl La O14 S2 -","- C24 H80 Cl4 La4 O56 S8 -","4","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.024","0.023","","0.03","","0.03","","","1.304","","","1.306","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052101","8.6666","0.0005","14.2258","0.0006","19.4202","0.0007","103.476","0.001","98.679","0.001","100.967","0.001","2237.55","0.18","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H48.5 O36.25 S6 Sm2 -","- C18 H38 O36.25 S6 Sm2 -","- C36 H76 O72.5 S12 Sm4 -","2","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.037","0.025","","0.037","","0.035","","","1.152","","","1.229","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052102","7.7426","0.0005","34.467","0.003","8.5532","0.0005","90","","111.174","0.001","90","","2128.4","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Eu2 O34 S6 -","- C18 H44 Eu2 O34 S6 -","- C36 H88 Eu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.042","0.03","","0.103","","0.06","","","1.777","","","1.092","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052103","7.7246","0.0004","34.366","0.002","8.5388","0.0004","90","","111.327","0.001","90","","2111.51","0.19","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Tb2 -","- C18 H44 O34 S6 Tb2 -","- C36 H88 O68 S12 Tb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.044","0.035","","0.054","","0.051","","","1.236","","","1.249","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052104","7.6984","0.0004","34.311","0.002","8.5293","0.0005","90","","111.463","0.001","90","","2096.7","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Y2 -","- C18 H44 O34 S6 Y2 -","- C36 H88 O68 S12 Y4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.052","0.039","","0.052","","0.05","","","1.203","","","1.249","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052105","7.664","0.0007","34.161","0.003","8.5009","0.0008","90","","111.641","0.001","90","","2068.7","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Lu2 O34 S6 -","- C18 H44 Lu2 O34 S6 -","- C36 H88 Lu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.025","0.025","","0.023","","0.023","","","1.298","","","1.353","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052106","6.491","0.001","18.388","0.004","7.23","0.001","90","","112.18","0.03","90","","799.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","guanidinium hydrogen succinate","Guanidinium hydrogen butanedicarboxylate'","","- C5 H11 N3 O4 -","- C5 H11 N3 O4 -","- C20 H44 N12 O16 -","4","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0669","0.06","","","0.1716","0.1796","","","","","","1.075","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052107","3.696","0.003","18.824","0.005","5.496","0.002","90","","94.76","0.04","90","","381.1","0.4","297","","297","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","guanidinium hydrogen fumarate","guanidinium hydrogen E-butenedicarboxylate","","- C5 H9 N3 O4 -","- C5 H9 N3 O4 -","- C10 H18 N6 O8 -","2","0.5","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","","0.053","","","","0.067","","","","","","2.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052108","5.284","0.002","8.501","0.003","10.466","0.004","69.1","0.03","77.91","0.03","89.42","0.03","428.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","guanidinium hydrogen adipate","Guanidinium hydrogen pentanedicarboxylate","","- C6 H13 N3 O4 -","- C6 H13 N3 O4 -","- C12 H26 N6 O8 -","2","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0346","0.0305","","","0.0783","0.0809","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052109","10.602","0.0003","10.9717","0.0003","12.6859","0.0004","90","","99.022","0.002","90","","1457.39","0.07","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C76 H68 N4 O8 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0538","0.0434","","","0.1209","0.1262","","","","","","1.043","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052110","10.702","0.0007","10.9624","0.0007","12.5151","0.0008","90","","98.443","0.003","90","","1452.35","0.16","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0864","0.0648","","","0.1466","0.1558","","","","","","1.07","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052111","7.034","0.0005","21.0718","0.0014","14.6964","0.001","90","","94.305","0.001","90","","2172.1","0.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl N O6 -","- C24 H25 Cl N O6 -","- C96 H100 Cl4 N4 O24 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0662","0.0443","","","0.122","0.1311","","","","","","0.983","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052112","14.135","0.004","7.983","0.002","25.02","0.007","90","","100.855","0.01","90","","2772.7","1.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Cl2 N O7 -","- C28 H34 Cl2 N O7 -","- C112 H136 Cl8 N4 O28 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.339","0.1576","","","0.4168","0.4553","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052113","10.9855","0.0012","10.8828","0.0012","12.212","0.0013","90","","98.282","0.005","90","","1444.8","0.3","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1123","0.069","","","0.1333","0.1472","","","","","","1.054","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052114","11.4976","0.0005","12.2916","0.0006","13.5348","0.0006","93.589","0.002","110.545","0.002","92.542","0.002","1783.11","0.14","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H36 Cl2 N2 O12 -","- C38 H36 Cl2 N2 O12 -","- C76 H72 Cl4 N4 O24 -","2","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1263","0.0614","","","0.135","0.1547","","","","","","0.938","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052115","7.7053","0.0009","20.304","0.002","14.3081","0.0015","90","","99.737","0.005","90","","2206.2","0.4","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H50 Cl2 N2 O12 -","- C48 H50 Cl2 N2 O11.2 -","- C96 H100 Cl4 N4 O22.4 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.2886","0.1495","","","0.3078","0.3606","","","","","","1.065","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052116","11.023","0.0004","11.2484","0.0004","12.5132","0.0005","82.944","0.002","76.649","0.002","61.394","0.002","1325.18","0.09","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","1","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0977","0.0523","","","0.1156","0.1283","","","","","","0.959","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052117","8.3685","0.0002","9.1253","0.0002","9.7248","0.0003","69.2894","0.001","82.1053","0.001","77.1832","0.0014","675.92","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","mar147","","","- C12 H14 F3 N O5 -","- C12 H14 F3 N O5 -","- C24 H28 F6 N2 O10 -","2","1","","Alberto Avenoza; Jesús H. Busto; Noelia Canal; José I. García; Gonzalo Jiménez-Osés; Jesús M. Peregrina; Marta Pérez-Fernández","Mechanistic study of the ring-size modulation in Michael?Dieckmann type reactions of 2-acylaminoacrylates with ketene diethyl acetal","New Journal of Chemistry","2007","31","2","224","","10.1039/b615220a","","","0.71073","MoKα","","0.0542","0.0385","","","0.09","0.0979","","","","","","1.045","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052118","13.6418","0.0016","16.7","0.002","20.05","0.002","85.446","0.008","83.877","0.007","70.685","0.007","4281.3","0.9","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H105 F12 N5 O27 P4 -","- C78 H105 F12 N5 O27 P4 -","- C156 H210 F24 N10 O54 P8 -","2","1","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.1011","0.0627","","","0.153","0.1777","","","","","","0.994","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052119","14.3358","0.0019","16.055","0.002","20.135","0.003","90","","101.999","0.009","90","","4533","1.1","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H102 F24 N6 O18 P4 -","- C80 H102 F24 N6 O18 P4 -","- C160 H204 F48 N12 O36 P8 -","2","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0667","0.0436","","","0.1091","0.1192","","","","","","1.092","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052120","10.7969","0.0013","11.6598","0.0014","13.4326","0.0016","69.073","0.002","66.558","0.002","76","0.002","1439.2","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0438","0.0355","","","0.0956","0.102","","","","","","1.041","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052121","10.405","0.002","11.148","0.002","14.021","0.003","69.539","0.003","81.494","0.003","74.025","0.003","1462.5","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0748","0.0592","","","0.1653","0.1782","","","","","","1.02","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052122","11.7067","0.0011","12.1212","0.0011","13.9127","0.0013","94.769","0.006","110.295","0.006","109.052","0.006","1706.7","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0953","0.0508","","","0.1098","0.1261","","","","","","1.025","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052123","17.349","0.002","33.402","0.004","42.855","0.005","90","","93.069","0.002","90","","24798","5","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C212 H198 N20 O88 S16 -","- C212 H134 N20 O88 S16 -","- C848 H536 N80 O352 S64 -","4","0.5","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.3617","0.2234","","","0.4862","0.5783","","","","","","0.985","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052124","17.195","0.001","17.804","0.003","23.132","0.002","78.326","0.009","86.573","0.004","68.775","0.009","6464","1.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C116 H142 N12 O58 S8 -","- C116 H132 N12 O58 S8 -","- C232 H264 N24 O116 S16 -","2","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.2007","0.1382","","","0.3765","0.4013","","","","","","1.022","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052125","49.471","0.002","11.382","0.001","21.92","0.001","90","","115.321","0.004","90","","11156.9","1.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H53 N4 O24 S4 -","- C48 H37 N4 O23.97 S4 -","- C384 H296 N32 O191.76 S32 -","8","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.1444","0.1391","","","0.317","0.3218","","","","","","1.086","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052126","11.6399","0.0004","12.1551","0.0004","12.5581","0.0004","75.915","0.002","72.576","0.002","76.92","0.002","1621.52","0.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H31 Cl2 N5 O10 -","- C27 H29 N5 O10 -","- C54 H58 N10 O20 -","2","1","","Sessler, Jonathan L.; Barkey, Natalie M.; Pantos, G. Dan; Lynch, Vincent M.","Acyclic pyrrole-based anion receptors: design, synthesis, and anion-binding properties","New Journal of Chemistry","2007","31","5","646","","10.1039/b615673h","","","0.71073","MoKα","","0.1227","0.0735","","","0.1973","0.2147","","","","","","1.165","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052127","16.2474","0.0007","16.2674","0.0007","20.5931","0.0007","83.54","0.003","76.736","0.003","71.072","0.002","5006.9","0.4","173","0.1","173","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C180 H187 Cl6 N9 O32 S8 -","2","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.2545","0.1274","","","0.3377","0.3917","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052128","29.3447","0.0009","22.6903","0.0005","22.2725","0.0007","90","","109.033","0.001","90","","14019.2","0.7","173","0.2","173","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C142 H147.5 N9.5 O25 S8 -","- C142 H147.5 N9.5 O25 S8 -","- C568 H590 N38 O100 S32 -","4","0.5","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.22","0.0913","","","0.2217","0.2794","","","","","","1.044","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052129","8.218","0.0004","11.3823","0.0004","17.5254","0.0009","90","","101.113","0.002","90","","1608.58","0.13","173","0.2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C72 H68 N4 O12 S4 -","4","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.0654","0.0399","","","0.0831","0.0918","","","","","","1.047","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052130","8.2722","0.0011","11.2447","0.0016","37.776","0.005","90","","90","","90","","3513.9","0.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-[(1R,2S,5R)-(-)-menthoxymethyl]-3-methylimidazolium chloride hydrate","","- C15 H29 Cl N2 O2 -","- C15 H29 Cl N2 O2 -","- C120 H232 Cl8 N16 O16 -","8","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0802","0.0486","","","0.0765","0.0838","","","","","","1.015","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052131","13.0143","0.0014","8.0671","0.0008","17.9287","0.0018","90","","103.636","0.002","90","","1829.2","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-ethylimidazolium chloride hemihydrate","","- C16 H30 Cl N2 O1.5 -","- C16 H29 Cl N2 O1.5 -","- C64 H116 Cl4 N8 O6 -","4","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0982","0.0569","","","0.1478","0.1668","","","","","","0.993","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052132","9.4408","0.001","34.119","0.004","12.1754","0.0013","90","","90.292","0.002","90","","3921.8","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-propylimidazolium chloride hemihydrate","","- C17 H32 Cl N2 O1.5 -","- C17 H32 Cl N2 O1.5 -","- C136 H256 Cl8 N16 O12 -","8","4","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.1361","0.0651","","","0.1222","0.1471","","","","","","0.99","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052133","14.2033","0.0003","16.447","0.0004","20.4164","0.0005","90","","90","","90","","4769.31","0.19","100","2","100","2","","","","","","","synthesized","6","P b c a","-P 2ac 2ab","61","","","","- C46 H34 Cl6 I4 N2 O2 -","- C46 H34 Cl6 I4 N2 O2 -","- C184 H136 Cl24 I16 N8 O8 -","4","0.5","","Arunkumar, Easwaran; Sudeep, Pallikkara K.; Kamat, Prashant V.; Noll, Bruce C.; Smith, Bradley D.","Singlet oxygen generation using iodinated squaraine and squaraine-rotaxane dyes.","New journal of chemistry = Nouveau journal de chimie","2007","31","5","677","683","10.1039/b616224j","","x-ray","0.71073","MoKα","","0.0322","0.0213","","","0.0467","0.0512","","","","","","1.038","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052134","25.43","0.004","11.8649","0.0017","16.688","0.002","90","","90","","90","","5035.2","1.2","293","2","293","2","","","","","","","","5","P m c 21","P 2c -2","26","","","","- C40 H63 Cu2 N10 O16.5 -","- C40 H60 Cu2 N10 O16.5 -","- C160 H240 Cu8 N40 O66 -","4","1","","Boiocchi, Massimo; Bonizzoni, Marco; Moletti, Alberto; Pasini, Dario; Taglietti, Angelo","Linear recognition of dicarboxylates by ditopic macrocyclic complexes","New Journal of Chemistry","2007","31","3","352","","10.1039/b616492g","","","0.71073","MoKα","","0.0976","0.0574","","","0.1447","0.1708","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052135","16.0948","0.0001","26.2675","0.0001","19.298","0.0001","90","","90","","90","","8158.62","0.07","173","1","173","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C42 H56 N4 O2 S4 -","- C42 H56 N4 O2 S4 -","- C336 H448 N32 O16 S32 -","8","1","","Martin Valik; Vladimir Král; Eberhardt Herdtweck; Franz P. Schmidtchen","Sulfoniumcalixpyrrole: the decoration of a calix[4]pyrrole host with positive charges boosts affinity and selectivity of anion binding in DMSO solvent","New Journal of Chemistry","2007","31","5","703","","10.1039/b617465e","","","0.71073","MoKα","","0.0432","0.0354","","","0.0859","0.0908","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052136","9.014","0.0008","14.873","0.002","16.749","0.002","77.96","0.01","83.05","0.01","77.57","0.01","2137.8","0.4","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C52 H56 N2 O2 -","- C52 H56 N2 O2 -","- C104 H112 N4 O4 -","2","1","","Stéphanie Leroy-Lhez; Magali Allain; Jean Oberlé; Frédéric Fages","Synthesis and zinc(ii) complexation modulated fluorescence emission properties of two pyrene-oligo(phenylene vinylene)-2,2?-bipyridine conjugated molecular rods","New Journal of Chemistry","2007","31","6","1013","","10.1039/b617497c","","x-ray","0.71073","MoKα","","","0.0471","","","","0.1413","","","","","","0.794","","","","has coordinates","301851","2025-08-21","20:32:39",""
"7052137","37.1517","0.0005","37.1517","0.0005","19.4231","0.0003","90","","90","","120","","23217","0.6","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C54 H58 Br2 N2 O4 -","- C54 H58 Br2 N2 O4 -","- C972 H1044 Br36 N36 O72 -","18","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core–shell dendrimers with a polycationic core: structural aspects and host–guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0758","0.0586","","","0.1749","0.1881","","","","","","1.082","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052138","9.9322","0.0002","13.9718","0.0002","19.304","0.0004","100.327","0.001","92.3451","0.0008","103.829","0.0009","2549.18","0.08","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H61 N4 O5 S -","- C59 H61 N4 O5 S -","- C118 H122 N8 O10 S2 -","2","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core–shell dendrimers with a polycationic core: structural aspects and host–guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0604","0.0433","","","0.1055","0.1142","","","","","","1.026","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052139","8.907","0.0009","5.6894","0.0008","13.0599","0.0013","90","","90.588","0.012","90","","661.78","0.13","180","","180","","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N2 -","- C8 H8 N2 -","- C32 H32 N8 -","4","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.042","0.0368","","","0.091","0.0943","","","","","","1.063","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052140","12.5397","0.0018","12.5397","0.0018","4.3463","0.0009","90","","90","","120","","591.87","0.17","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H5 F3 N2 -","- C8 H5 F3 N2 -","- C24 H15 F9 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1277","0.0885","","","0.1489","0.1687","","","","","","1.048","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052141","12.5382","0.0018","12.5382","0.0018","4.9499","0.001","90","","90","","120","","673.9","0.19","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H F7 N2 -","- C8 H F7 N2 -","- C24 H3 F21 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1385","0.0418","","","0.0713","0.0934","","","","","","0.92","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052142","9.3629","0.0013","10.7928","0.0009","12.9505","0.0016","68.589","0.008","83.856","0.009","85.975","0.007","1210.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","1","0.5","","Koval, Iryna A.; Akhideno, Hilda; Tanase, Stefania; Belle, Catherine; Duboc, Carole; Saint-Aman, Eric; Gamez, Patrick; Tooke, Duncan M.; Spek, Anthony L.; Pierre, Jean-Louis; Reedijk, Jan","Changes in magnetic properties from solid state to solution in a trinuclear linear copper(ii) complex","New Journal of Chemistry","2007","31","4","512","","10.1039/b618154f","","","0.71073","MoKα","","0.0378","0.0312","","","0.0826","0.0864","","","","","","1.048","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052143","6.5739","0.0013","11.597","0.002","12.604","0.003","90","","90.13","0.03","90","","960.9","0.3","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperazinediium bis(4-aminobenzoate) dihydrate","piperazinediium bis(4-aminobenzoate) dihydrate","","- C18 H28 N4 O6 -","- C18 H28 N4 O6 -","- C36 H56 N8 O12 -","2","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.042","0.0373","","","0.1039","0.1073","","","","","","1.005","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052144","19.0506","0.0013","12.12","0.0009","14.4397","0.001","90","","107.72","0.001","90","","3175.8","0.4","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8- diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8-diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","","- C30 H52 N6 O5 -","- C30 H52 N6 O5 -","- C120 H208 N24 O20 -","4","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","0.71073","MoKα","","0.0619","0.0484","","","0.1211","0.1283","","","","","","1.006","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052145","9.6004","0.0019","11.35","0.002","12.088","0.002","90","","111.91","0.03","90","","1222","0.5","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H38 N6 O6 -","- C22 H38 N6 O6 -","- C44 H76 N12 O12 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.04","0.0366","","","0.0881","0.0906","","","","","","1.009","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052146","10.9044","0.0014","9.9475","0.0013","12.1429","0.0015","90","","114.267","0.002","90","","1200.8","0.3","90","2","90","2","","","","","","","","4","P 1 c 1","P -2yc","7","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H36 N4 O8 -","- C22 H36 N4 O8 -","- C44 H72 N8 O16 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0381","0.0349","","","0.08","0.0825","","","","","","1.004","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052147","24.784","0.004","9.6757","0.0017","10.0867","0.0018","90","","90","","90","","2418.8","0.7","90","2","90","2","","","","","","","","4","P c a 21","P 2c -2ac","29","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","","- C19 H38 N2 O10 -","- C19 H38 N2 O10 -","- C76 H152 N8 O40 -","4","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0575","0.0424","","","0.0848","0.0913","","","","","","0.996","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052148","14.2714","0.0009","12.8482","0.001","39.425","0.003","90","","104.958","0.007","90","","6984.1","0.9","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 Cl4 Fe O2 S16 -","- C22 H12 Cl4 Fe O2 S16 -","- C176 H96 Cl32 Fe8 O16 S128 -","8","2","","Jean-Philippe Savy; Dominique de Caro; Christophe Faulmann; Lydie Valade; Manuel Almeida; Tadahiro Koike; Hideki Fujiwara; Toyonari Sugimoto; Jordi Fraxedas; Thierry Ondarçuhu; Claude Pasquier","Nanowires of molecule-based charge-transfer salts","New Journal of Chemistry","2007","31","4","519","","10.1039/b618241k","","","0.71073","MoKα","","0.1466","0.1038","","","0.2551","0.2693","","","","","","1.063","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052149","20.562","0.004","8.4423","0.0017","14.824","0.003","90","","106.93","0.03","90","","2461.8","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N2 O Se -","- C12 H16 N2 O Se -","- C96 H128 N16 O8 Se8 -","8","1","","Bruce, Jocelyn C.; Revaprasadu, Neerish; Koch, Klaus R.","Cadmium(ii) complexes of N,N-diethyl-N′-benzoylthio(seleno)urea as single-source precursors for the preparation of CdS and CdSe nanoparticles","New Journal of Chemistry","2007","31","9","1647","","10.1039/b618254b","","","0.71073","MoKα","","0.0247","0.0228","","","0.0585","0.0592","","","","","","1.095","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052150","8.73","0.0013","13.374","0.002","17.707","0.003","90","","95.956","0.003","90","","2056.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1","","","- C19 H24 Cl2 Cu N4 O -","- C19 H24 Cl2 Cu N4 O -","- C76 H96 Cl8 Cu4 N16 O4 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.072","0.0521","","","0.1197","0.1284","","","","","","1.027","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052151","8.59","0.002","12.854","0.003","18.163","0.004","90","","91.596","0.004","90","","2004.7","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C18 H21 Cl2 Cu N5 -","- C18 H21 Cl2 Cu N5 -","- C72 H84 Cl8 Cu4 N20 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1973","0.1044","","","0.1959","0.231","","","","","","1.084","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052152","12.8579","0.0011","14.746","0.0013","13.8823","0.0012","90","","98.669","0.002","90","","2602","0.4","303","2","303","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","10","","","- C22 H32 Cl2 Cu N6 O2 -","- C22 H32 Cl2 Cu N6 O2 -","- C88 H128 Cl8 Cu4 N24 O8 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1436","0.0837","","","0.1932","0.2273","","","","","","1.015","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052153","8.598","0.003","13.177","0.004","18.105","0.006","90","","95.181","0.006","90","","2042.8","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C34 H40 Cl8 Cu2 N8 -","- C34 H40 Cl8 Cu2 N8 -","- C68 H80 Cl16 Cu4 N16 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.12","0.062","","","0.1108","0.1307","","","","","","0.966","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052154","8.826","0.003","13.103","0.005","18.057","0.006","90","","95.838","0.007","90","","2077.4","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","4","","","- C40 H52 Cl4 Cu2 N8 O2 -","- C40 H52 Cl4 Cu2 N8 O2 -","- C80 H104 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1549","0.0908","","","0.1486","0.1706","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052155","8.8822","0.0014","13.05","0.002","17.792","0.003","90","","95.486","0.003","90","","2052.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","5","","","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C72 H96 Cl8 Cu4 N16 O4 S4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.0757","0.0516","","","0.1074","0.1161","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052156","8.4038","0.0015","12.927","0.002","18.195","0.003","90","","91.267","0.003","90","","1976.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","6","","","- C36 H44 Cl4 Cu2 N8 O2 -","- C36 H44 Cl4 Cu2 N8 O2 -","- C72 H88 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1056","0.0721","","","0.1311","0.1414","","","","","","1.153","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052157","15.7","0.013","21.205","0.018","8.132","0.007","90","","121.048","0.013","90","","2319","3","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","7","","","- C35 H39 Cl13 Cu2 N8 -","- C35 H39 Cl13 Cu2 N8 -","- C70 H78 Cl26 Cu4 N16 -","2","0.25","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1739","0.0824","","","0.1724","0.2169","","","","","","0.955","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052158","8.6006","0.0017","13.126","0.003","17.942","0.004","87.547","0.004","87.705","0.004","81.627","0.004","2000.9","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","8","","","- C38 H48 Cl4 Cu2 N8 O3 -","- C38 H48 Cl4 Cu2 N8 O3 -","- C76 H96 Cl8 Cu4 N16 O6 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1327","0.0879","","","0.1568","0.1733","","","","","","1.116","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7052159","8.539","0.005","10.673","0.006","13.386","0.007","104.272","0.01","91.858","0.01","112.793","0.009","1078.7","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","9","","","- C18 H22 Cl4 Cu N4 -","- C18 H22 Cl4 Cu N4 -","- C36 H44 Cl8 Cu2 N8 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1259","0.0731","","","0.142","0.1655","","","","","","0.959","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052160","8.5803","0.0012","11.9991","0.0015","12.9458","0.0018","90","","92.406","0.017","90","","1331.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Ni S4 -","- C11 H13 Ni S4 -","- C44 H52 Ni4 S16 -","4","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1075","0.0454","","","0.0744","0.089","","","","","","0.842","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052161","8.769","0.001","9.318","0.0012","10.3604","0.0015","87.844","0.016","83.577","0.015","62.422","0.013","745.55","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 Ni S4 -","- C15 H13 Ni S4 -","- C30 H26 Ni2 S8 -","2","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1208","0.0752","","","0.2006","0.2299","","","","","","0.98","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052162","14.1796","0.0013","14.1796","0.0013","25.007","0.002","90","","90","","120","","4354.3","0.7","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","bis(mu2-R,R-N,N'-(2-methyl-8-methoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C56 H56 Cl2 Cu2 N8 O12 -","- C56 H56 Cl2 Cu2 N8 O12 -","- C168 H168 Cl6 Cu6 N24 O36 -","3","0.5","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1557","0.089","","","0.2429","0.2853","","","","","","0.974","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052163","13.8593","0.0016","12.171","0.0019","20.914","0.002","90","","90","","90","","3527.8","0.8","293","2","293","2","","","","","","","","6","I 2 2 2","I 2 2","23","bis(mu2-R,R-N,N'-(2-methyl-8-buthoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C68 H80 Cl2 Cu2 N8 O12 -","- C68 H80 Cl2 Cu2 N8 O12 -","- C136 H160 Cl4 Cu4 N16 O24 -","2","0.25","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1482","0.0638","","","0.1369","0.1776","","","","","","0.992","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052164","13.409","0.003","14.202","0.003","15.345","0.003","109.09","0.03","99.73","0.03","99.82","0.03","2640.6","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H60 N4 O5 Zn2 -","- C61 H60 N4 O5 Zn2 -","- C122 H120 N8 O10 Zn4 -","2","1","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc–salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.127","0.0651","","","0.1263","0.1608","","","","","","1.032","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052165","21.55","0.004","11.749","0.002","30.5348","0.0006","90","","109.83","0.03","90","","7273","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37.78 H41.78 Cl2.34 N3 O2 Zn -","- C37.7805 H41 Cl2.3415 N3 O2 Zn -","- C302.244 H328 Cl18.732 N24 O16 Zn8 -","8","2","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc‒salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.2408","0.1953","","","0.4063","0.4311","","","","","","1.124","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052166","23.3924","0.0017","9.5829","0.0007","19.3455","0.0014","90","","126.649","0.001","90","","3479.3","0.4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 O2 -","- C26 H16 O2 -","- C208 H128 O16 -","8","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0439","0.0356","","","0.0917","0.0944","","","","","","1.024","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052167","5.686","0.0015","10.21","0.003","14.072","0.004","97.506","0.004","92.789","0.004","90.58","0.004","808.9","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H12 O2 S2 -","- C22 H12 O2 S2 -","- C44 H24 O4 S4 -","2","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0605","0.0428","","","0.0987","0.1085","","","","","","0.958","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052168","8.736","0.006","8.973","0.006","18.358","0.012","89.562","0.013","88.762","0.012","81.196","0.012","1421.7","1.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C72 H88 O2 -","- C72 H88 O2 -","- C72 H88 O2 -","1","0.5","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.1054","0.0556","","","0.1114","0.1261","","","","","","0.879","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052169","9.563","","12.095","","13.129","","73.31","","69.31","","88.65","","1355.62","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)2(Mo6Cl14)","","","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.7107","MoKα","","0.162","0.06","","","0.0955","0.1181","","","","","","1.004","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052170","10.392","","13.868","","18.026","","91.19","","102.84","","107.28","","2408.03","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)4(Mo6Cl14)","","","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.71073","MoKα","","0.1425","0.0528","","","0.1095","0.1354","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052171","10.3656","0.0004","14.7041","0.0006","11.0971","0.0004","90","","111.493","0.002","90","","1573.77","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H15 Ag Cl N6 O6 -","- C10 H13 Ag Cl N6 O6 -","- C40 H52 Ag4 Cl4 N24 O24 -","4","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.0902","0.0523","","","0.131","0.1469","","","","","","1.04","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052172","12.2251","0.0007","15.406","0.009","19.7291","0.001","90","","90","","90","","3716","2","250","","250","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H19 Ag Cl N7 O5 -","- C12 H19 Ag Cl N7 O5 -","- C96 H152 Ag8 Cl8 N56 O40 -","8","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.1999","0.1142","","0.1415","0.1095","0.1095","","","","","","1.0707","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052173","7.2707","0.0006","12.3313","0.001","28.699","0.002","90","","96.684","0.002","90","","2555.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 N2 Pt -","- C33 H24 N2 Pt -","- C132 H96 N8 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71073","MoKα","","0.0423","0.0399","","","0.1001","0.1008","","","","","","1.581","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052174","7.301","0.005","12.688","0.005","25.728","0.005","90","","90","","90","","2383.3","1.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H21 N3 Pt -","- C31 H21 N3 Pt -","- C124 H84 N12 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71069","MoKα","","0.0425","0.0307","","","0.0762","0.0901","","","","","","1.159","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052175","13.641","0.003","17.738","0.004","18.898","0.004","75.86","0.03","82.89","0.03","84.78","0.03","4391.2","1.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H78 Cl4 N15 O28.5 S4 Zn2 -","- C78 H77 Cl4 N15 O28.5 S4 Zn2 -","- C156 H154 Cl8 N30 O57 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","","0.71073","MoKα","","0.1106","0.056","","","0.1368","0.1612","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052176","16.9511","0.0003","18.4571","0.0003","20.1644","0.0004","108.458","0.001","103.302","0.001","110.497","0.001","5176.27","0.18","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C79 H80.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C79 H78.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C158 H157 Ba4 Cl16 N31 O90 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","x-ray","1.54178","CuKα","","0.0771","0.0525","","","0.1281","0.1419","","","","","","0.996","","","","has coordinates","288091","2023-12-06","15:51:23",""
"7052177","6.35","0.0013","10.747","0.002","13.239","0.003","90","","92.69","0.03","90","","902.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Al N2 O -","- C16 H33 Al N2 O -","- C32 H66 Al2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.1041","0.0679","","","0.1507","0.1679","","","","","","1.072","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052178","6.35","0.0013","10.729","0.002","13.273","0.003","90","","92.61","0.03","90","","903.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Ga N2 O -","- C16 H33 Ga N2 O -","- C32 H66 Ga2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.0962","0.0897","","","0.2239","0.2302","","","","","","1.134","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052179","12.707","0.003","11.963","0.002","17.66","0.004","90","","95.14","0.03","90","","2673.8","1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H50 Al N3 O2 -","- C25 H50 Al N3 O2 -","- C100 H200 Al4 N12 O8 -","4","1","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.097","0.0599","","","0.1197","0.1356","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052180","12.081","0.001","17.513","0.001","12.328","0.001","90","","118.022","0.001","90","","2302.5","0.3","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H29 P Si2 -","- C23 H29 P Si2 -","- C92 H116 P4 Si8 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0573","0.041","","","0.1117","0.1197","","","","","","1.076","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052181","6.24","0.001","12.986","0.001","27.663","0.001","90","","90","","90","","2241.6","0.4","150","0.1","150","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 P S -","- C29 H21 P S -","- C116 H84 P4 S4 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0511","0.0384","","","0.0933","0.099","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052182","17.932","0.001","12.292","0.001","20.981","0.001","90","","90","","90","","4624.6","0.5","150","0.1","150","0.1","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C23 H29 P S Si2 -","- C23 H29 P S Si2 -","- C184 H232 P8 S8 Si16 -","8","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.043","0.0332","","","0.094","0.0998","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052183","9.273","0.002","9.672","0.002","21.274","0.004","97.75","0.03","91.62","0.03","117.78","0.03","1663.6","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Bis(n-tert-butyl-N'(diisopropoxyphosphoryl)-thiocaramido- N',S)nickel(ii)","Bis[n-tert-butyl-N'(diisopropoxyphosphoryl)- thiocaramido-N',S]nickel(II)","","- C22 H48 N4 Ni O6 P2 S2 -","- C22 H48 N4 Ni O6 P2 S2 -","- C44 H96 N8 Ni2 O12 P4 S4 -","2","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0823","0.0483","","","0.1114","0.1233","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052184","12.194","0.002","8.439","0.002","16.951","0.003","90","","91.55","0.03","90","","1743.7","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S)nickel(ii)","Bis[N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S]nickel(II)","","- C14 H44 N4 Ni O8 P2 S2 -","- C28 H44 N4 Ni O8 P2 S2 -","- C56 H88 N8 Ni2 O16 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1451","0.061","","","0.0996","0.1148","","","","","","0.924","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052185","10.403","0.002","8.304","0.002","20.958","0.006","90","","105.78","0.03","90","","1742.3","0.8","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","Bis(N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S)nickel(ii)","Bis[N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S]nickel(II)","","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C52 H76 Br4 N8 Ni2 O12 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.126","0.0542","","","0.0894","0.1083","","","","","","0.997","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052186","18.981","0.004","9.764","0.002","16.498","0.003","90","","97.89","0.03","90","","3028.6","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Bis(N-(diisopropoxyphosphoryl)-N'-isopropylthiocarbamido- N,S)palladium(ii)","Bis[N-(diisopropoxyphosphoryl)-N'- isopropylthiocarbamido-N,S]palladium(II)","","- C20 H44 N4 O6 P2 Pd S2 -","- C20 H44 N4 O6 P2 Pd S2 -","- C80 H176 N16 O24 P8 Pd4 S8 -","4","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1088","0.0524","","","0.0693","0.0777","","","","","","1.006","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052187","18.747","0.004","17.566","0.004","19.95","0.004","90","","100.046","0.005","90","","6469","2","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S)palladium(ii)","Bis[morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S]palladium(II)","","- C22 H44 N4 O8 P2 Pd S2 -","- C22 H44 N4 O8 P2 Pd S2 -","- C176 H352 N32 O64 P16 Pd8 S16 -","8","2","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0959","0.0555","","","0.0892","0.1","","","","","","1.036","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052188","9.6504","0.0007","11.4015","0.0008","9.651","0.0007","90","","100.871","0.001","90","","1042.83","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 N2 S2 -","- C10 H8 N2 S2 -","- C40 H32 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0418","0.0346","","","0.0912","0.0973","","","","","","0.994","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052189","4.5456","0.0002","26.9807","0.0013","10.0137","0.0005","90","","97.484","0.001","90","","1217.65","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0416","0.0304","","","0.073","0.0779","","","","","","0.988","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052190","10.6766","0.0006","11.5253","0.0006","10.2713","0.0006","90","","96.797","0.001","90","","1255.01","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0854","0.049","","","0.1112","0.1259","","","","","","1.037","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052191","14.294","0.001","14.848","0.001","16.671","0.007","65.42","0.02","86.24","0.02","84.8","0.01","3202.8","1.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H81 Cl2 O20 V5 -","- C45 H81 Cl2 O20 V5 -","- C90 H162 Cl4 O40 V10 -","2","1","","Sañudo, E. Carolina; Ribas, Joan; Winpenny, Richard E. P.","Solid state synthesis of [V5O2(Me3CCO2)9Cl2]","New Journal of Chemistry","2007","31","8","1421","","10.1039/b704191h","","","0.6933","synchrotron","","0.075","0.0478","","","0.1195","0.1349","","","","","","1.041","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052192","13.184","0.003","5.7697","0.001","18.696","0.004","90","","100.833","0.016","90","","1396.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O2 S -","- C14 H16 N2 O2 S -","- C56 H64 N8 O8 S4 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.1395","0.0632","","","0.1731","0.2117","","","","","","1.038","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052193","9.0457","0.0015","18.882","0.003","16.057","0.003","90","","105.144","0.003","90","","2647.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C112 H108 N12 O16 S8 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","0.71073","MoKα","","0.0832","0.0457","","","0.1168","0.1286","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052194","8.797","0.005","10.788","0.004","14.713","0.008","100.53","0.05","101.7","0.05","100.23","0.06","1310.4","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.0636","0.0522","","","0.1465","0.1561","","","","","","1.046","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052195","10.2059","0.0006","10.7345","0.0005","12.8784","0.0005","97.962","0.004","95.36","0.005","108.697","0.005","1309.19","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.54184","CuKα","","0.0581","0.0555","","","0.1596","0.1627","","","","","","1.059","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052196","8.25","0.001","8.25","0.001","7.15","0.001","90","","90","","120","","421.45","0.09","293","2","293","2","","","","","","","","4","P 3 c 1","P 3 -2""c","158","","","","- C6 H11 N3 O3 -","- C6 H11.02 N3.01 O3 -","- C12 H22.04 N6.02 O6 -","2","0.333333","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0503","0.0355","","","0.0926","0.1007","","","","","","1.103","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052197","8.42266","0.00014","6.97215","0.000061","8.06305","0.00013","90","","98.6845","0.0014","90","","468.066","0.012","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","1,3-dimethylbarbiturate methylammonium","","- C7 H13 N3 O3 -","- C7 H13 N3 O3 -","- C14 H26 N6 O6 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","1.5406","CuKα","","","","","","","","","","1.23","","","","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052198","8.5","0.002","10.56","0.003","11.412","0.002","65.843","0.017","88.118","0.018","71.467","0.019","880.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H23 N5 O9 -","- C13 H23 N5 O9 -","- C26 H46 N10 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid–gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1382","0.0468","","","0.117","0.161","","","","","","0.918","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052199","11.29","0.005","19.761","0.006","8.3","0.003","90","","95.17","","90","","1844.2","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H24 N6 O6 -","- C14 H24 N6 O6 -","- C56 H96 N24 O24 -","4","0.5","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid–gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1389","0.0583","","","0.1588","0.2106","","","","","","0.957","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052200","8.495","0.001","12.416","0.002","12.697","0.002","110.082","0.002","95.887","0.002","95.181","0.002","1239.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 N7 O9 -","- C20 H31 N7 O9 -","- C40 H62 N14 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid–gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0643","0.0457","","","0.1309","0.1453","","","","","","0.834","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052201","5.691","0.001","9.359","0.001","41.058","0.001","90","","90","","90","","2186.8","0.5","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 Br2 O6 -","- C23 H20 Br2 O6 -","- C92 H80 Br8 O24 -","4","1","","Albrecht, Markus; Schmid, Sören; Dehn, Sabrina; Wickleder, Claudia; Zhang, Shuang; Bassett, Andrew P.; Pikramenou, Zoe; Fröhlich, Roland","Diastereoselective formation of luminescent dinuclear lanthanide(iii) helicates with enantiomerically pure tartaric acid derived bis(β-diketonate) ligands","New Journal of Chemistry","2007","31","10","1755","","10.1039/b705090a","","","0.71073","MoKα","","0.0741","0.0424","","","0.0809","0.0913","","","","","","1.013","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052202","19.0372","0.0007","22.9422","0.0007","30.2456","0.0013","90","","90","","90","","13209.9","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C71 H101 N O9 -","- C71 H101 N O9 -","- C568 H808 N8 O72 -","8","1","","Marcos, Paula M.; Félix, Sandra; Ascenso, José R.; Segurado, Manuel A. P.; Thuéry, Pierre; Mellah, Besma; Michel, Sylvia; Hubscher-Bruder, Véronique; Arnaud-Neu, Françoise","Complexation and transport of transition and heavy metal cations by p-tert-butyldihomooxacalix[4]arene tetraketones and X-ray crystal structure of the tert-butyl ketone derivative","New Journal of Chemistry","2007","31","12","2111","","10.1039/b705879a","","","0.71073","MoKα","","0.1381","0.0776","","","0.196","0.2175","","","","","","1.026","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052203","9.884","0.014","11.444","0.014","12.684","0.017","74.4","0.01","77.902","0.01","66.15","0.01","1256","3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 N6 -","- C28 H24 N6 -","- C56 H48 N12 -","2","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1483","0.0695","","","0.1646","0.2038","","","","","","0.67","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052204","12.7999","0.0011","14.3093","0.0015","17.1281","0.0013","90","","103.118","0.007","90","","3055.3","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 F6 N6 O2 P Zn -","- C30 H27 F6 N6 O2 P Zn -","- C120 H108 F24 N24 O8 P4 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1559","0.0776","","","0.1984","0.212","","","","","","0.872","","","","has coordinates,has disorder","301851","2025-08-21","20:32:40",""
"7052205","10.263","0.011","15.745","0.017","21.37","0.02","90","","103.106","0.01","90","","3363","6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cl2 N6 O10 Zn -","- C28 H26 Cl2 N6 O9.99 Zn -","- C112 H104 Cl8 N24 O39.96 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1091","0.0875","","","0.1637","0.1719","","","","","","1.226","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052206","17.8554","0.0009","15.7085","0.0009","17.7912","0.0009","90","","96.224","0.003","90","","4960.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H50 Mn4 N4 O24 P2 -","- C38 H50 Mn4 N4 O24 P2 -","- C152 H200 Mn16 N16 O96 P8 -","4","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.04","","","0.1101","0.1134","","","","","","1.004","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052207","10.08","0.003","11.084","0.003","11.559","0.003","64.798","0.005","81.789","0.007","82.715","0.006","1153.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0316","","","0.0855","0.0887","","","","","","0.997","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052208","11.4387","0.0014","11.485","0.0012","11.9747","0.0011","100.459","0.001","103.024","0.004","113.282","0.003","1342","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0558","","","0.1564","0.1726","","","","","","1.053","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052209","18.0431","0.0007","11.0649","0.0003","21.7461","0.0009","90","","91.002","0.002","90","","4340.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H72 Mn4 N6 O24 P2 -","- C86 H66 Mn4 N6 O24 P2 -","- C172 H132 Mn8 N12 O48 P4 -","2","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0409","","","0.1143","0.1208","","","","","","1.005","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052210","27.766","0.0014","11.5247","0.0006","21.2342","0.001","90","","94.895","0.002","90","","6770.1","0.6","163.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H76 Na2 O50 S12 -","- C36 H18 Na2 O46.5 S12 -","- C144 H72 Na8 O186 S48 -","4","0.5","","Yamada, Manabu; Kondo, Yoshihiko; Akimoto, Kazuhiko; Kabuto, Chizuko; Hamada, Fumio","Supramolecular assembly based on p-sulfonatothiacalix[6]arene with sodium and water molecules","New Journal of Chemistry","2007","31","11","1874","","10.1039/b706891c","","","0.71069","MoKα","","","0.1034","","","","0.2714","","","","","","1.128","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052211","26.349","0.005","12.877","0.003","25.364","0.005","90","","111.33","0.05","90","","8016","4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C244 H316 Mn20 N60 Na8 O104 S16 -","4","1","","Beghidja, Chahrazed; Rogez, Guillaume; Welter, Richard","Synthesis, crystal structure and magnetic properties of a new mixed-valence [Mn4IIIMnII] pentanuclear complex","New Journal of Chemistry","2007","31","8","1403","","10.1039/b707170a","","","0.71069","MoKα","","0.153","0.0847","","","0.1264","0.1569","","","","","","1.114","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052212","17.118","0.004","11.668","0.003","18.793","0.005","90","","99.925","0.006","90","","3697.4","1.6","298","2","298","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36.5 H41 F6 Fe N2 Ni O2 P Ru -","- C33 H37 F6 Fe N2 Ni O2 P Ru -","- C132 H148 F24 Fe4 N8 Ni4 O8 P4 Ru4 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.2755","0.0844","","","0.1926","0.2538","","","","","","0.801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052213","11.0723","0.001","9.9509","0.0009","18.5611","0.0017","90","","106.637","0.001","90","","1959.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Fe N2 Ni O2 -","- C23 H22 Fe N2 Ni O2 -","- C92 H88 Fe4 N8 Ni4 O8 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.0573","0.0438","","","0.109","0.117","","","","","","1.043","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052214","7.4291","0.0004","9.8933","0.0006","11.8779","0.0007","73.116","0.003","78.757","0.003","86.088","0.004","819.28","0.08","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","Compound X","","","- C11 H11 Fe2 N O7 S2 -","- C11 H11 Fe2 N O7 S2 -","- C22 H22 Fe4 N2 O14 S4 -","2","1","","Capon, Jean-François; Ezzaher, Salah; Gloaguen, Frédéric; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean; Davin, Thomas J.; McGrady, John E.; Muir, Kenneth W.","Electrochemical and theoretical investigations of the reduction of [Fe2(CO)5L{µ-SCH2XCH2S}] complexes related to [FeFe] hydrogenase","New Journal of Chemistry","2007","31","12","2052","","10.1039/b709273c","","x-ray","0.71073","MoKα","","0.0386","0.0299","","","0.0747","0.0799","","","","","","1.091","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052215","44.988","0.018","9.206","0.004","16.552","0.006","90","","108.938","0.007","90","","6484","5","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H45 Fe N O11 -","- C31 H45 Fe N O11 -","- C248 H360 Fe8 N8 O88 -","8","1","","McKeogh, Ian; Hill, Jonathan P.; Collins, Emily S.; McCabe, Thomas; Powell, Annie K.; Schmitt, Wolfgang","Self-assembly of FeIII complexes via hydrogen bonded water molecules into supramolecular coordination networks","New Journal of Chemistry","2007","31","11","1882","","10.1039/b711185a","","","0.71073","MoKα","","0.0518","0.0393","","","0.1042","0.1143","","","","","","1.097","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052216","9.25","0.002","12.011","0.003","14.326","0.004","90","","92.618","0.003","90","","1590","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15.5 Cd1.5 N5 O5.75 -","- C11 H14 Cd1.5 N5 O5.75 -","- C44 H56 Cd6 N20 O23 -","4","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","The first 2D trinuclear Cd(ii)-complex with adenine nucleobase: hydrothermal synthesis, crystal structure and fluorescent properties","New Journal of Chemistry","2007","31","11","1887","","10.1039/b712387f","","","0.71073","MoKα","","0.0511","0.0362","","","0.0836","0.0918","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052217","21.66","0.004","4.7544","0.0009","9.9321","0.0019","90","","93.912","0.003","90","","1020.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-((1-pyrazolyl)methyl)benzamide","4-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C44 H44 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.1042","0.0522","","","0.1146","0.1342","","","","","","0.974","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052218","8.4005","0.0007","8.0671","0.0007","18.0477","0.0018","90","","102.621","0.006","90","","1193.5","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C52 H60 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0892","0.0491","","","0.1184","0.1309","","","","","","0.934","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052219","12.437","0.003","8.8195","0.0017","12.468","0.002","90","","114.488","0.006","90","","1244.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","BS-3-93-3G 3-((4-bromo-3,5-dimethylpyrazol-1- yl)methyl)benzamide, succinic acid","BS-3-93-3G 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide, succinic acid","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0319","0.0234","","","0.0588","0.0622","","","","","","1.026","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052220","7.7873","0.0005","8.113","0.0006","8.84","0.0006","77.6614","0.0013","74.4604","0.0013","68.3976","0.0012","496.14","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","3-((1-pyrazolyl)methyl)benzamide","3-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C22 H22 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0489","0.0449","","","0.1249","0.1292","","","","","","1.081","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052221","8.0162","0.0004","8.0603","0.0004","10.4542","0.0005","97.253","0.002","106.06","0.002","109.335","0.002","594.57","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","BS-3-92-4 3-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","BS-3-92-4 3-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C26 H30 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0556","0.0434","","","0.1205","0.1299","","","","","","1.083","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7052222","8.9062","0.0012","11.6933","0.0018","14.146","0.002","73.396","0.01","74.274","0.009","70.553","0.009","1305.8","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","BS-3-93-4f 3-((3-bromo-2,4-dimethylpyrazol-1- yl)methyl)benzamide","BS-3-93-4f 3-[(3-bromo-2,4-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","2","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.145","0.0704","","","0.1928","0.2376","","","","","","1.033","","","","has coordinates","301851","2025-08-21","20:32:40",""
"7053692","7.4575","0.0012","11.6882","0.0012","12.8664","0.0015","114.651","0.01","94.767","0.011","101.729","0.01","980.1","0.2","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C8 H11 N5 O3 -","- C8 H11 N5 O3 -","- C32 H44 N20 O12 -","4","2","","Corral, Eva; Kooijman, Huub; Spek, Anthony L.; Reedijk, Jan","Nucleic acids in two dimensions: layers of base pairs linked by carboxylate","New Journal of Chemistry","2007","31","1","21","","10.1039/b613845d","","x-ray","0.71073","MoKα","","0.0673","0.0515","","","0.1417","0.154","","","","","","1.085","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053693","9.7867","0.001","28.1721","0.0026","15.7764","0.0016","90","","94.616","0.004","90","","4335.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cis- and trans-bis(benzoylacetonato)pyridinecopper(ii)","cis- and trans-bis(benzoylacetonato)pyridinecopper(II)","","- C25 H23 Cu N O4 -","- C25 H23 Cu N O4 -","- C200 H184 Cu8 N8 O32 -","8","2","","Lennartson, Anders; Håkansson, Mikael; Jagner, Susan","cis- and trans-Bis(benzoylacetonato)pyridinecopper(ii): co-crystallisation of isomers and reversible pyridine loss with retention of crystallinity","New Journal of Chemistry","2007","31","3","344","347","10.1039/b615579k","","","0.71073","MoKα","","0.0332","0.03","","","0.072","0.0739","","","","","","0.855","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053694","16.449","0.002","28.272","0.004","29.144","0.004","90","","90.614","0.003","90","","13553","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C145 H147.5 N13.5 O26.5 Zn8 -","- C149.25 H135.5 N8.5 O26.5 Zn8 -","- C597 H542 N34 O106 Zn32 -","4","1","","Power, Nicholas P.; Dalgarno, Scott J.; Atwood, Jerry L.","Robust and stable pyrogallol[4]arene molecular capsules facilitated via an octanuclear zinc coordination belt","New Journal of Chemistry","2007","31","1","17","","10.1039/b615947h","","","0.71073","MoKα","","0.0932","0.0566","","","0.1555","0.1868","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053695","9.2003","0.0004","16.578","0.0008","20.418","0.001","90","","101.307","0.001","90","","3053.8","0.2","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 F3 N2 O18 Re3 S4 -","- C18 F3 N2 O18 Re3 S4 -","- C72 F12 N8 O72 Re12 S16 -","4","1","","Tzeng, Biing-Chiau; Wu, Ya-Ling; Lee, Gene-Hsiang; Peng, Shie-Ming","A novel trinuclear Re(i) complex containing 1,3,4-thiadiazole-2,5-dithiolate: structural and spectroscopic properties","New Journal of Chemistry","2007","31","2","199","","10.1039/b616122g","","","0.71073","MoKα","","0.0509","0.0383","","","0.0692","0.0728","","","","","","1.053","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053696","9.1246","0.001","20.319","0.002","47.951","0.005","90","","90","","90","","8890.2","1.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H36 N8 O5.08 S2 -","- C27 H36 N8 O5.08333 S2 -","- C324 H432 N96 O61 S24 -","12","3","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.105","0.0752","","","0.1644","0.1787","","","","","","1.091","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053697","10.857","0.0015","12.4706","0.0016","12.9263","0.0016","98.088","0.003","112.786","0.003","107.966","0.003","1465.8","0.3","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H38 N8 O5 S2 -","- C28 H38 N8 O5 S2 -","- C56 H76 N16 O10 S4 -","2","2","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0863","0.0812","","","0.2163","0.2213","","","","","","1.026","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053698","12.8416","0.001","8.7033","0.0007","13.7476","0.0011","90","","96.649","0.002","90","","1526.2","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H40 N8 O5 S2 -","- C29 H40 N8 O5 S2 -","- C58 H80 N16 O10 S4 -","2","1","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0346","0.0329","","","0.0881","0.0897","","","","","","1.032","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053699","10.7122","0.0009","11.9131","0.001","12.4072","0.001","105.252","0.002","93.448","0.002","113.481","0.002","1376.5","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","1","0.5","","Song, Limei; Wang, Qi; Tang, Daihua; Liu, Xinhou; Zhen, Zhen","Crystal structure and near-infrared luminescence properties of novel binuclear erbium and erbium?ytterbium cocrystalline complexes","New Journal of Chemistry","2007","31","4","506","","10.1039/b616422f","","","0.71073","MoKα","","0.0281","0.0253","","","0.065","0.0666","","","","","","1.049","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053700","10.1714","0.0003","10.1756","0.0003","13.1069","0.0004","107.535","0.002","92.714","0.002","91.38","0.002","1291.03","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H37.8 N4 O1.9 -","- C29 H37.8 N4 O1.9 -","- C58 H75.6 N8 O3.8 -","2","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.1112","0.0693","","","0.1779","0.2009","","","","","","0.967","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053701","19.7663","0.0015","11.8837","0.0008","15.7559","0.0014","90","","106.807","0.004","90","","3542.9","0.5","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H41.5 N6.5 O -","- C42 H41.5 N6.5 O -","- C168 H166 N26 O4 -","4","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.2209","0.0907","","","0.2159","0.2756","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053702","10.146","0.0002","26.3142","0.0009","26.8959","0.0009","90","","98.04","0.002","90","","7110.2","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H48 N4 O5 S -","- C37 H48 N4 O5 S -","- C296 H384 N32 O40 S8 -","8","2","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.195","0.1076","","","0.2649","0.3182","","","","","","0.905","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053703","10.3228","0.0004","11.9213","0.0004","15.8916","0.0006","71.948","0.002","88.95","0.002","74.63","0.002","1788.52","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","para-butylcalix(4)arene","","","- C44 H56 O4 -","- C44 H56 O4 -","- C88 H112 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1102","0.0696","","","0.1891","0.2191","","","","","","1.069","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053704","11.0862","0.0015","14.413","0.002","14.802","0.002","78.182","0.002","74.463","0.002","88.892","0.002","2228.8","0.5","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-n-hexylcalix(4)arene","","","- C52 H72 O4 -","- C52 H72 O4 -","- C104 H144 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0628","0.0465","","","0.1263","0.141","","","","","","1.031","","","","has coordinates,has disorder","301851","2025-08-21","20:32:45",""
"7053705","11.611","0.003","17.372","0.004","33.165","0.007","88.536","0.003","88.251","0.004","87.077","0.004","6676","3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C52 H64 O8 -","- C52 H64 O8 -","- C312 H384 O48 -","6","3","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1089","0.0685","","","0.1869","0.2156","","","","","","0.989","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053706","12.053","0.003","12.441","0.003","16.015","0.003","91.504","0.003","99.841","0.003","95.036","0.003","2354.9","0.9","398","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C54 H70 O9 -","- C54 H70 O9 -","- C108 H140 O18 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1063","0.0742","","","0.2076","0.226","","","","","","1.058","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053707","9.0322","0.0007","13.6639","0.0011","15.2661","0.0012","86.472","0.001","76.962","0.001","86.25","0.001","1829.4","0.3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","parabutanoylcalix(4)arene","","","- C44 H48 O8 -","- C44 H48 O8 -","- C88 H96 O16 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0493","0.0436","","","0.1211","0.1273","","","","","","1.038","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053708","11.63","0.002","15.163","0.003","33.741","0.006","90","","99.117","0.003","90","","5874.9","1.9","125","2","125","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-decanoylcalix(4)arene","","","- C68 H96 O8 -","- C68 H96 O8 -","- C272 H384 O32 -","4","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1637","0.1234","","","0.278","0.29","","","","","","1.126","","","","has coordinates,has disorder","301851","2025-08-21","20:32:45",""
"7053709","21.7615","0.0012","15.6647","0.0008","32.8323","0.0016","90","","107.905","0.003","90","","10650.1","1","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-octanoylcalix(4)arene","","","- C60 H80 O8 -","- C60 H80 O8 -","- C480 H640 O64 -","8","2","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1881","0.0839","","","0.2006","0.2921","","","","","","1.027","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053710","11.2883","0.0004","13.0045","0.0004","14.3048","0.0006","84.252","0.002","82.162","0.002","88.661","0.002","2069.75","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","bis(ethylenediamine)diaquacopper(ii) catena- bis(ethylenediamine) (aqua)copper(ii)(mu- aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(ii)) hydrate","bis(ethylenediamine)diaquacopper(II) catena-bis(ethylenediamine) (aqua)copper(II)(mu-aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(II)) hydrate","","- C16 H54 Cu6 N8 O31 -","- C16 H54 Cu6 N8 O31 -","- C32 H108 Cu12 N16 O62 -","2","1","","Gumienna-Kontecka, Elzbieta; Golenya, Irina A.; Dudarenko, Nikolay M.; Dobosz, Agnieszka; Haukka, Matti; Fritsky, Igor O.; Swiatek-Kozlowska, Jolanta","A new Cu(ii) [12]metallocrown-4 pentanuclear complex based on a Cu(ii)-malonomonohydroxamic acid unit","New Journal of Chemistry","2007","31","10","1798","","10.1039/b701600j","","","0.71073","MoKα","","0.0811","0.0434","","","0.0933","0.1063","","","","","","1.027","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053711","23.2509","0.0016","23.2509","0.0016","11.492","0.0016","90","","90","","90","","6212.6","1.1","130","2","130","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C22 H53 N3 O2.5 Os P2 Si2 -","- C22 H53 N3 O2.5 Os P2 Si2 -","- C176 H424 N24 O20 Os8 P16 Si16 -","8","1","","Lee, Joo-Ho; Fan, Hongjun; Pink, Maren; Caulton, Kenneth G.","Reactivity of ?NO with an osmium polyhydride: Reductive elimination and reductive nitrosylation on the path from odd- to even-electron molecules","New Journal of Chemistry","2007","31","6","838","","10.1039/b702078c","","","0.71073","MoKα","","0.0331","0.0252","","","0.0593","0.0631","","","","","","1.066","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053713","12.921","0.002","8.1511","0.0015","16.069","0.003","90","","96.767","0.003","90","","1680.6","0.5","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N5 -","- C20 H19 N5 -","- C80 H76 N20 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0672","0.0431","","","0.1102","0.1291","","","","","","1.01","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053714","12.609","0.003","15.421","0.003","14.505","0.003","90","","110.09","0.03","90","","2648.8","1.1","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Cl2 N5 O4 Zn -","- C25 H27 Cl2 N5 O4 Zn -","- C100 H108 Cl8 N20 O16 Zn4 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0814","0.0627","","","0.1211","0.1278","","","","","","1.142","","","","has coordinates","301851","2025-08-21","20:32:45",""
"7053724","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","150","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C10 H7 O3.5 -","- C240 H168 O84 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.3731","0.3692","","","0.75","0.7561","","","","","","8.178","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053725","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","296","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C17.25 O5 -","- C414 O120 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.2663","0.2609","","","0.6108","0.6184","","","","","","5.895","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054165","12.261","0.005","13.887","0.006","20.738","0.008","89.996","0.007","88.163","0.007","85.016","0.007","3516","2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C108 H138 Cl4 N8 O43 Zn8 -","2","1","","Chen, Zhanfen; Wang, Xiaoyong; Chen, Jingwen; Yang, Xiaoliang; Li, Yizhi; Guo, Zijian","Selective sensing of dihydrogen phosphate anion by a fluorescent tetranuclear pentacoordinated zinc(ii) complex","New Journal of Chemistry","2007","31","3","357","","10.1039/b616451j","","","0.71073","MoKα","","0.0884","0.061","","","0.1207","0.1268","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054166","8.7192","0.0007","26.3","0.001","15.251","0.002","90","0.005","91.521","0.006","90","0.004","3496.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","awc8040_KS","","","- C64 H56 Br8 O9 -","- C64 H56 Br8 O9 -","- C128 H112 Br16 O18 -","2","0.5","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.147","0.085","","","0.237","0.2693","","","","","","1.032","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054167","15.8507","0.0003","16.6896","0.0003","18.4507","0.0004","107.079","0.001","90.82","0.001","114.725","0.001","4184.8","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","awc8044","","","- C88 H104 Br8 O8 -","- C88 H104 Br8 O8 -","- C176 H208 Br16 O16 -","2","1","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.119","0.079","","","0.164","0.181","","","","","","1.07","","","","has coordinates,has disorder","301851","2025-08-21","20:32:46",""
"7054168","14.752","0.001","5.7461","0.0002","17.339","0.001","90","","90.87","0.01","90","","1469.6","0.14","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(phenylethynyl)thiophene","","- C20 H12 S -","- C20 H12 S -","- C80 H48 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.1032","0.0497","","","0.1042","0.1272","","","","","","1.01","","","","has coordinates","301851","2025-08-21","20:32:46",""
"7054169","16.0717","0.0015","5.0902","0.0005","21.2336","0.0019","90","","112.217","0.01","90","","1608.1","0.3","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(p-methylphenylethynyl)thiophene","","- C22 H16 S -","- C22 H16 S -","- C88 H64 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0688","0.0464","","","0.1001","0.1087","","","","","","1.022","","","","has coordinates","301851","2025-08-21","20:32:46",""
"7054170","7.1798","0.0008","45.453","0.004","5.8879","0.0004","90","","90","","90","","1921.5","0.3","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,5-bis(p-carbomethoxyphenylethynyl)thiophene","","- C24 H16 O4 S -","- C24 H16 O4 S -","- C96 H64 O16 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0504","0.0463","","","0.1135","0.1159","","","","","","1.039","","","","has coordinates","301851","2025-08-21","20:32:46",""
"7054171","4.9212","0.0007","31.274","0.004","11.3413","0.0015","90","","101.83","0.01","90","","1708.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-bis(pentafluorophenylethynyl)thiophene","","- C20 H2 F10 S -","- C20 H2 F10 S -","- C80 H8 F40 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0652","0.0474","","","0.1028","0.11","","","","","","1.099","","","","has coordinates","301851","2025-08-21","20:32:46",""
"7054172","14.566","0.002","25.954","0.003","25.644","0.003","90","","99.295","0.002","90","","9567","2","153","2","153","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C76 H115 O44 P2 S4 Yb -","- C76 H59 O44.01 P2 S4 Yb -","- C304 H236 O176.04 P8 S16 Yb4 -","4","2","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.1869","0.1476","","","0.3611","0.3923","","","","","","1.113","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054173","32.032","0.005","11.43","0.002","50.944","0.007","90","","91.744","0.002","90","","18643","5","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C156 H180 Cl Gd2.67 Na2 O78 P3 S12 -","- C156 H120 Cl Gd2.66 Na2 O78 P3 S12 -","- C624 H480 Cl4 Gd10.64 Na8 O312 P12 S48 -","4","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.2607","0.1206","","","0.2897","0.3779","","","","","","1.063","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054174","14.624","0.001","19.987","0.002","25.192","0.002","67.801","0.001","74.982","0.001","89.74","0.001","6548.7","1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C217 H314 Cl Gd5.33 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","1","0.5","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0874","0.0699","","","0.1794","0.195","","","","","","1.048","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054175","12.6687","0.0008","14.9526","0.0009","18.497","0.002","96.405","0.007","100.594","0.008","107.678","0.006","3228.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H59.5 O33.5 P S4 Yb -","- C53 H42 O33.5 P S4 Yb -","- C106 H84 O67 P2 S8 Yb2 -","2","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0835","0.0556","","","0.1384","0.1498","","","","","","1.007","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054176","10.747","0.0002","13.1706","0.0002","18.122","0.0004","90","","90","","90","","2565.07","0.08","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Catena-[tris(5-tertbutylpyrazole)sulfatocobalt(II)]","","- C21 H36 Co N6 O4 S -","- C21 H36 Co N6 O4 S -","- C84 H144 Co4 N24 O16 S4 -","4","1","","Jones, Leigh F.; Kilner, Colin A.; Halcrow, Malcolm A.","A comparison of different methods for fitting susceptibility data of cobalt(ii) coordination polymers in a new cobalt(ii)/sulfate 1-D chain","New Journal of Chemistry","2007","31","8","1530","","10.1039/b700987a","","","0.71073","MoKα","","0.0363","0.0314","","","0.0743","0.077","","","","","","1.028","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054177","7.7471","0.0009","11.7596","0.0015","19.604","0.002","90","","90.778","0.005","90","","1785.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 Fe2 N O6 S2 -","- C13 H13 Fe2 N O6 S2 -","- C52 H52 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.048","","","0.0928","0.1028","","","","","","1.084","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054178","9.6577","0.0002","13.0873","0.0001","14.9696","0.0002","90","","92.793","0.001","90","","1889.81","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Fe2 N O6 S2 -","- C14 H15 Fe2 N O6 S2 -","- C56 H60 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0521","","","0.1259","0.1328","","","","","","1.024","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054179","10.604","0.003","12.035","0.004","15.428","0.004","90","","92.439","0.006","90","","1967.1","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 Fe2 N O6 S2 -","- C15 H17 Fe2 N O6 S2 -","- C60 H68 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.031","","","0.0894","0.1074","","","","","","1.097","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054180","12.4237","0.0005","14.1988","0.0006","14.6021","0.0006","98.333","0.001","91.911","0.001","94.471","0.001","2538.28","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H31 Fe2 N O4 P2 S2 -","- C17 H31 Fe2 N O4 P2 S2 -","- C68 H124 Fe8 N4 O16 P8 S8 -","4","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0785","","","0.2815","0.3076","","","","","","0.992","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054181","22.819","0.005","10.912","0.002","23.588","0.005","90","","118.581","0.002","90","","5157.7","1.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Fe2 N O4 P2 S2 -","- C18 H33 Fe2 N O4 P2 S2 -","- C144 H264 Fe16 N8 O32 P16 S16 -","8","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0568","","","0.0973","0.1064","","","","","","1.108","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054182","11.0584","0.0006","22.4454","0.001","11.6423","0.0006","90","","113.615","0.002","90","","2647.7","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H35 Fe2 N O4 P2 S2 -","- C19 H35 Fe2 N O4 P2 S2 -","- C76 H140 Fe8 N4 O16 P8 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.041","","","0.1335","0.1394","","","","","","1.071","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054183","9.9882","0.0004","14.1537","0.0005","14.7208","0.0008","64.158","0.002","86.751","0.003","70.732","0.003","1758.73","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H39 N9 O7 S2 -","- C33 H39 N9 O7 S2 -","- C66 H78 N18 O14 S4 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0976","0.0561","","","0.1274","0.1467","","","","","","1.023","","","","has coordinates,has disorder","301851","2025-08-21","20:32:46",""
"7054184","19.3932","0.0004","5.8774","0.0001","19.4872","0.0004","90","","102.842","0.001","90","","2165.62","0.07","120","2","120","2","","","","","","","Matthew Fisher","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 N7 O3 S -","- C23 H21 N7 O3 S -","- C92 H84 N28 O12 S4 -","4","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0681","0.0505","","","0.1252","0.1377","","","","","","1.082","","","","has coordinates","301851","2025-08-21","20:32:46",""
"7054185","10.5481","0.0003","13.6951","0.0004","16.4507","0.0006","87.777","0.002","80.974","0.002","77.225","0.002","2288.88","0.13","120","2","120","2","","","","","","","Matthew Fisher","4","P -1","-P 1","2","","","","- C49 H49.67 N15 O7.34 -","- C49 H49.66 N15 O7.33 -","- C98 H99.32 N30 O14.66 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.1353","0.097","","","0.2437","0.2727","","","","","","1.064","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7209363","4.67","","4.67","","11.73","","90","","90","","90","","255.818","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr Ag2 Sn2","","- Ag2 Sn2 Sr -","- Ag2 Sn2 Sr -","- Ag4 Sn4 Sr2 -","2","0.0625","","Niess, N.; Schaefer, H.; Doerrscheidt, W.","Neue Verbindungen A B2 X2 (A= Erdalkalimetall, B= Uebergangselement, X= Element(IV)) im ThCr2Si2-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","890","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209379","6.159","","10.439","","5.972","","90","","90","","90","","383.963","","","","","","","","","","","","","3","I b a m","-I 2 2c","72","","Na Ag3 O2","","- Ag3 Na O2 -","- Ag3 Na O2 -","- Ag12 Na4 O8 -","4","0.25","","Jansen, M.","Ueber Na Ag3 O2","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1544","1544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209403","4.32","","4.32","","10.02","","90","","90","","90","","186.997","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ca Au2 Si2","","- Au2 Ca Si2 -","- Au2 Ca Si2 -","- Au4 Ca2 Si4 -","2","0.0625","","Doerrscheidt, W.; Niess, N.; Schaefer, H.","Neue Verbindungen A B2 X2 (A= Erdalkalimetall, B= Uebergangselement, X= Element(IV)) im ThCr2Si2-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","890","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209413","4.37","","4.37","","10.14","","90","","90","","90","","193.643","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr Au2 Si2","","- Au2 Si2 Sr -","- Au2 Si2 Sr -","- Au4 Si4 Sr2 -","2","0.0625","","Doerrscheidt, W.; Niess, N.; Schaefer, H.","Neue Verbindungen A B2 X2 (A= Erdalkalimetall, B= Uebergangselement, X= Element(IV)) im ThCr2Si2-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","890","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7222693","4.17","","4.17","","10.88","","90","","90","","90","","189.191","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Ca Mn2 Ge2","","- Ca Ge2 Mn2 -","- Ca Ge2 Mn2 -","- Ca2 Ge4 Mn4 -","2","0.0625","","Doerrscheidt, W.; Niess, N.; Schaefer, H.","Neue Verbindungen A B2 X2 (A= Erdalkalimetall, B= Uebergangselement, X= Element(IV)) im ThCr2Si2-Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","890","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222755","5.676","","5.676","","10.76","","90","","90","","90","","346.655","","","","","","","","","","","","","3","I -4","I -4","82","","Mn Ga2 Se4","","- Ga2 Mn Se4 -","- Ga2 Mn Se4 -","- Ga4 Mn2 Se8 -","2","0.25","","Range, K.J.; Huebner, H.","Mn Ga2 Se4 und Mn Ga2 Te4","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","886","887","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7223700","4.52","","4.52","","4.52","","90","","90","","90","","92.345","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Na4 Pt O4).8","","- Na3.2 O3.2 Pt0.8 -","- Na3.2 O3.2 Pt0.8 -","- Na3.2 O3.2 Pt0.8 -","1","0.00520833","","Hauck, J.","Zur Kristallstruktur von Natriumplatinaten(IV)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1179","1182","","","","","","","","","","","","","","","","","","","","","","has coordinates","172732","2020-10-21","18:00:00",""
"7223701","4.487","","4.487","","4.487","","90","","90","","90","","90.338","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Na2 Pt O3)1.33","","- Na2.66 O3.99 Pt1.33 -","- Na2.68 O4 Pt1.32 -","- Na2.68 O4 Pt1.32 -","1","0.00520833","","Hauck, J.","Zur Kristallstruktur von Natriumplatinaten(IV)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1976","31","","1179","1182","","","","","","","","","","","","","","","","","","","","","","has coordinates","172733","2020-10-21","18:00:00",""
"9000030","3.835","","3.835","","5.255","","90","","90","","120","","66.932","","","","","","","","","","","","","2","P -3 m 1","-P 3 2""","164","","","Melonite","- Ni Te2 -","- Ni Te2 -","- Ni Te2 -","1","0.0833333","","Peacock, M. A.; Thompson, R. M.","On melonite from Quebec and the crystal structure of NiTe2","American Mineralogist","1946","31","","204","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000031","3.073","","3.073","","128.15","","90","","90","","120","","1048.03","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-V","","","- C17 Si17 -","- C17 Si17 -","- C51 Si51 -","3","0.166667","","Ramsdell, L. S.","The crystal structure of alpha-SiC, type V","American Mineralogist","1946","31","","205","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9004260","6.841","","6.841","","6.702","","90","","90","","120","","271.628","","","","","","","","","","","","","10","P 31","P 31","144","","","Stillwellite-(Ce)","- B Ca0.01 Ce0.49 La0.35 Nd0.07 O6 Pr0.03 Si Sm0.01 Th0.05 -","- B Ca0.01 Ce0.49 La0.35 Nd0.07 O6 Pr0.03 Si Sm0.01 Th0.05 -","- B3 Ca0.03 Ce1.47 La1.05 Nd0.21 O18 Pr0.09 Si3 Sm0.03 Th0.15 -","3","1","","Burns, P. C.; Hawthorne, F. C.; MacDonald, D. J.; Ventura, G. D.; Parodi, G.","The crystal structure of stillwellite","The Canadian Mineralogist","1993","31","","147","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004261","8.905","","5.684","","10.113","","90","","114.62","","90","","465.345","","","","","","","","","","","","Balchen Mountain, East Antartica","12","P 1 21/m 1","-P 2yb","11","","","Dissakisite-(Ce)","- Al1.83 Ca Ce0.57 Fe0.145 H La0.33 Mg0.855 Nd0.07 O13 Pr0.03 Si3 Ti0.17 -","- Al1.83 Ca Ce0.57 Fe0.145 H La0.33 Mg0.855 Nd0.07 O13 Pr0.03 Si3 Ti0.17 -","- Al3.66 Ca2 Ce1.14 Fe0.29 H2 La0.66 Mg1.71 Nd0.14 O26 Pr0.06 Si6 Ti0.34 -","2","0.5","","Rouse, R. C.; Peacor, D. R.","The crystal structure of dissakisite-(Ce),the Mg analogue of allanite-(Ce)","The Canadian Mineralogist","1993","31","","153","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004262","8.712","","11.247","","6.091","","90","","110.12","","90","","560.398","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","Colemanite","- B3 Ca0.94 H5 O8 -","- B3 Ca0.94 H5 O8 -","- B12 Ca3.76 H20 O32 -","4","1","","Burns, P. C.; Hawthorne, F. C.","Hydrogen bonding in colemanite: An X-ray and structure-energy study","The Canadian Mineralogist","1993","31","","297","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004263","6.632","","8.337","","6.4748","","90.81","","101.97","","86.76","","349.653","","","","","","","","","","","","Mount Blanco, Death Valley, California, USA","4","P -1","-P 1","2","","","Meyerhofferite","- B3 Ca H7 O9 -","- B3 Ca H7 O9 -","- B6 Ca2 H14 O18 -","2","1","","Burns, P. C.; Hawthorne, F. C.","Hydrogen bonding in meyerhofferite: An X-ray and structure energy study from Mount Blanco, Death Valley, California","The Canadian Mineralogist","1993","31","","305","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004264","10.118","","7.238","","13.965","","90","","106.62","","90","","979.988","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","Dietzeite","- Ca2 Cr H2 I2 O11 -","- Ca2 Cr H2 I2 O11 -","- Ca8 Cr4 H8 I8 O44 -","4","1","","Burns, P. C.; Hawthorne, F. C.","The crystal structure of dietzeite, Ca2H20(IO3)2(CrO4), a heteropolyhedral framework mineral","The Canadian Mineralogist","1993","31","","313","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9004265","8.337","","10.367","","7.629","","104.46","","93.81","","104.18","","613.285","","","","","","","","","","","","","5","P -1","-P 1","2","","","Akatoreite","- Al2 H8 Mn9 O32 Si8 -","- Al2 H8 Mn9 O32 Si8 -","- Al2 H8 Mn9 O32 Si8 -","1","0.5","","Burns, P. C.; Hawthorne, F. C.","Edge-sharing MnO4 tetrahedra in the structure of akatoreite, Mn9Al2Si8O24(OH)8","The Canadian Mineralogist","1993","31","","321","329","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9004266","5.838","","7.224","","8.69","","90","","90","","90","","366.49","","","","","","","","","","","","Cerchiara Mine, Northern Apennines, Italy","5","P 21 21 21","P 2ac 2ab","19","","","Mozartite","- Al0.06 Ca Mn0.94 O5 Si -","- Al0.06 Ca Mn0.94 O5 Si -","- Al0.24 Ca4 Mn3.76 O20 Si4 -","4","1","","Basso, R.; Lucchetti, G.; Zefiro, L.; Palenzona, A.","Mozartite, CaMn(OH)SiO4, a new mineral species from the Cerchiara Mine, Northern Apennines, Italy","The Canadian Mineralogist","1993","31","","331","336","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004267","6.248","","6.248","","26.802","","90","","90","","120","","906.108","","","","","","","","","","","","Arcedeckne Island, Artic Canada","6","R -3 m :H","-R 3 2""","166","","","Harrisonite","- Ca Fe5.28 Mg0.72 O16 P2 Si2 -","- Ca Fe5.28 Mg0.72 O16 P2 Si2 -","- Ca3 Fe15.84 Mg2.16 O48 P6 Si6 -","3","0.0833333","","Grice, J. D.; Roberts, A. C.","Harrisonite, a well-ordered silico-phosphate with a layered crystal structure. Ca(Fe,Mg)6(SiO4)2(PO4)2 Locality: Arcedeckne Island, Artic Canada","The Canadian Mineralogist","1993","31","","781","785","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9007270","8.2796","","8.2796","","8.2796","","90","","90","","90","","567.581","","","","296.15","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesioferrite","- Al0.79 Fe1.21 Mg O4 -","- Al0.79 Fe1.21 Mg O4 -","- Al6.32 Fe9.68 Mg8 O32 -","8","0.0416667","","Nakatsuka, A.; Ueno, H.; Nakayama, N.; Mizota, T.; Maekawa, H.","Single-crystal X-ray diffraction study of cation distribution in MgAl2O4-MgFe2O4 spinel solid solution Sample: T = 23 C, x = 1.21","Physics and Chemistry of Minerals","2004","31","","278","287","10.1007/s00269-004-0385-z","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007271","8.3252","","8.3252","","8.3252","","90","","90","","90","","577.011","","","","296.15","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesioferrite","- Al0.47 Fe1.52 Mg O4 -","- Al0.47 Fe1.52 Mg O4 -","- Al3.76 Fe12.16 Mg8 O32 -","8","0.0416667","","Nakatsuka, A.; Ueno, H.; Nakayama, N.; Mizota, T.; Maekawa, H.","Single-crystal X-ray diffraction study of cation distribution in MgAl2O4-MgFe2O4 spinel solid solution Sample: T = 23 C, x = 1.53","Physics and Chemistry of Minerals","2004","31","","278","287","10.1007/s00269-004-0385-z","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007272","8.3422","","8.3422","","8.3422","","90","","90","","90","","580.553","","","","296.15","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesioferrite","- Al0.22 Fe1.77 Mg1.01 O4 -","- Al0.22 Fe1.77 Mg1.01 O4 -","- Al1.76 Fe14.16 Mg8.08 O32 -","8","0.0416667","","Nakatsuka, A.; Ueno, H.; Nakayama, N.; Mizota, T.; Maekawa, H.","Single-crystal X-ray diffraction study of cation distribution in MgAl2O4-MgFe2O4 spinel solid solution Sample: T = 23 C, x = 1.77","Physics and Chemistry of Minerals","2004","31","","278","287","10.1007/s00269-004-0385-z","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007273","8.36","","8.36","","8.36","","90","","90","","90","","584.277","","","","296.15","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesioferrite","- Fe2 Mg O4 -","- Fe2 Mg O4 -","- Fe16 Mg8 O32 -","8","0.0416667","","Nakatsuka, A.; Ueno, H.; Nakayama, N.; Mizota, T.; Maekawa, H.","Single-crystal X-ray diffraction study of cation distribution in MgAl2O4-MgFe2O4 spinel solid solution Sample: T = 23 C, x = 2.00","Physics and Chemistry of Minerals","2004","31","","278","287","10.1007/s00269-004-0385-z","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007274","4.6975","","4.206","","2.8327","","90","","90","","90","","55.968","","","","","","","","","","","","","5","P n n 2","P 2 -2n","34","","","delta-AlOOH","- Al0.84 H Mg0.07 O2 Si0.09 -","- Al0.84 H Mg0.07 O2 Si0.09 -","- Al1.68 H2 Mg0.14 O4 Si0.18 -","2","0.5","","Kudoh, Y.; Kuribayashi, T.; Suzuki, A.; Ohtani, E.; Kamada, T.","Space group and hydrogen sites of delta-AlOOH and implications for a hypothetical high-pressure form of Mg(OH)2","Physics and Chemistry of Minerals","2004","31","","360","364","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007275","9.466","","17.97","","5.288","","90","","101.84","","90","","880.372","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Ferri-clinoholmquistite","- Fe2.09 H2 Li1.46 Mg3.65 O24 Si8 -","- Fe2.09 H2 Li1.46 Mg3.65 O24 Si8 -","- Fe4.18 H4 Li2.92 Mg7.3 O48 Si16 -","2","0.25","","Iezzi, G.; Camara, F.; Della Ventura, G.; Oberti, R.; Pedrazzi, G.; Robert, J.-L.","Synthesis, crystal structure and crystal chemistry of ferri-clinoholmquistite, _Li2Mg3Fe3+2Si8O22(OH)2 Sample: 152","Physics and Chemistry of Minerals","2004","31","","375","385","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007276","14.7514","","13.0827","","7.5648","","90","","111.997","","90","","1353.64","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al2 Ca H10 O15.02 Si4 -","- Al2 Ca H6.04 O15.02 Si4 -","- Al8 Ca4 H24.16 O60.08 Si16 -","4","0.5","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = ambient","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007277","14.8831","","13.182","","7.5387","","90","","110.181","","90","","1388.21","","","","","","","","200000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al4 Ca2 H22 O33 Si8 -","- Al4 Ca2 H18 O33 Si8 -","- Al8 Ca4 H36 O66 Si16 -","2","0.25","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.2 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007278","14.8913","","13.1661","","7.5284","","90","","110.008","","90","","1386.94","","","","","","","","300000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al4 Ca2 H22 O33 Si8 -","- Al4 Ca2 H18 O33 Si8 -","- Al8 Ca4 H36 O66 Si16 -","2","0.25","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.3 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007279","14.8795","","13.1442","","7.5078","","90","","109.92","","90","","1380.52","","","","","","","","600000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al4 Ca2 H18 O33 Si8 -","- Al4 Ca2 H18 O33 Si8 -","- Al8 Ca4 H36 O66 Si16 -","2","0.25","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 0.6 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9007280","14.8486","","13.1211","","7.4774","","90","","110.001","","90","","1368.96","","","","","","","","1100000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al4 Ca2 H18 O33 Si8 -","- Al4 Ca2 H18 O33 Si8 -","- Al8 Ca4 H36 O66 Si16 -","2","0.25","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 1.1 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9007281","14.7934","","13.0979","","7.442","","90","","110.166","","90","","1353.58","","","","","","","","1700000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al4 Ca2 H18 O33 Si8 -","- Al4 Ca2 H18 O33 Si8 -","- Al8 Ca4 H36 O66 Si16 -","2","0.25","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 1.7 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9007282","14.7204","","13.1084","","7.408","","90","","110.512","","90","","1338.82","","","","","","","","2400000","","","","","5","C 1 2/m 1","-C 2y","12","","","Laumontite","- Al2 Ca H12 O16.5 Si4 -","- Al2 Ca H9 O16.5 Si4 -","- Al8 Ca4 H36 O66 Si16 -","4","0.5","","Lee, Y.; Hriljac, J. A.; Vogt, T.","Pressure-induced migration of zeolitic water in laumontite Sample: Pleasant Valley, Connecticut, NMNH R4159; P = 2.4 GPa","Physics and Chemistry of Minerals","2004","31","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9007283","12.048","","12.623","","6.511","","90","","114.58","","90","","900.474","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Alluaudite","- Fe Mn1.911 Na1.896 O12 P3 -","- Fe Mn1.911 Na1.896 O12 P3 -","- Fe4 Mn7.644 Na7.584 O48 P12 -","4","0.5","","Hatert, F.; Long, G. J.; Hautot, D.; Fransolet, A.-M.; Delwiche, J.; Hubin-Franskin M J; Grandjean, F.","A structural, magnetic, and Mossbauer spectral study of several Na-Mn-Fe-bearing alluaudites Sample: #1, synthetic","Physics and Chemistry of Minerals","2004","31","","487","506","10.1007/s00269-004-0400-4","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9007284","7.3559","","7.3559","","17.0186","","90","","90","","120","","797.491","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe2.919 H6 O14.905 S2 -","- Fe2.919 H6 O14.905 S2 -","- Fe8.757 H18 O44.715 S6 -","3","0.0833333","","Majzlan J; Stevens R; Boerio-Goates J; Woodfield B F; Navrotsky A; Burns P C; Crawford M K; Amos T G","Thermodynamic properties, low-temperature heat-capacity anomalies, and single-crystal X-ray refinement of hydronium jarosite, (H3O)Fe3(SO4)2(OH)6 Note: Single-crystal X-ray diffraction refinement","Physics and Chemistry of Minerals","2004","31","","518","531","10.1007/s00269-004-0405-z","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9007285","7.3499","","7.3499","","17.0104","","90","","90","","120","","795.807","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","","Hydronium jarosite","- Fe3 H9 O15 S2 -","- Fe3 O15 S2 -","- Fe9 O45 S6 -","3","0.0833333","","Majzlan J; Stevens R; Boerio-Goates J; Woodfield B F; Navrotsky A; Burns P C; Crawford M K; Amos T G","Thermodynamic properties, low-temperature heat-capacity anomalies, and single-crystal X-ray refinement of hydronium jarosite, (H3O)Fe3(SO4)2(OH)6 Note: Rietveld refinement of synchrotron X-ray diffraction pattern","Physics and Chemistry of Minerals","2004","31","","518","531","10.1007/s00269-004-0405-z","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9007286","5.0492","","5.0492","","17.343","","90","","90","","120","","382.913","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","Calcite","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Prencipe, M.; Pascale, F.; Zicovich-Wilson C M; Saunders, V. R.; Orlando, R.; Dovesi, R.","The vibrational spectrum of calcite (CaCO3): an ab initio quantum-mechanical calculation Note: Theoretically derived structure","Physics and Chemistry of Minerals","2004","31","","559","564","10.1007/s00269-004-0418-7","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9007287","5.79903","","15.1254","","6.18398","","90","","116.429","","90","","485.724","","","","4.2","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 4.2 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007288","5.799","","15.1255","","6.1839","","90","","116.428","","90","","485.722","","","","10","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 10 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007289","5.7991","","15.1251","","6.184","","90","","116.429","","90","","485.722","","","","20","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Note: Obvious typo in the x-coordinate of D2 corrected Sample: T = 20 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007290","5.799","","15.1255","","6.1839","","90","","116.427","","90","","485.727","","","","30","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 30 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007291","5.7991","","15.1253","","6.1842","","90","","116.428","","90","","485.748","","","","40","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 40 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007292","5.7992","","15.1256","","6.1844","","90","","116.426","","90","","485.79","","","","50","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 50 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007293","5.7994","","15.125","","6.185","","90","","116.426","","90","","485.835","","","","60","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 60 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007294","5.7997","","15.1257","","6.1857","","90","","116.425","","90","","485.942","","","","70","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 70 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007295","5.8","","15.1256","","6.1866","","90","","116.422","","90","","486.047","","","","80","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 80 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007296","5.8003","","15.1259","","6.1873","","90","","116.422","","90","","486.137","","","","90","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 90 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007297","5.8007","","15.1267","","6.1887","","90","","116.419","","90","","486.318","","","","100","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 100 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007298","5.8016","","15.1284","","6.1916","","90","","116.418","","90","","486.681","","","","125","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 125 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007299","5.8026","","15.1314","","6.1956","","90","","116.416","","90","","487.184","","","","150","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 150 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007300","5.804","","15.1361","","6.2006","","90","","116.414","","90","","487.855","","","","175","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 175 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007301","5.8053","","15.142","","6.206","","90","","116.413","","90","","488.584","","","","200","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 200 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007302","5.8062","","15.1482","","6.2118","","90","","116.41","","90","","489.329","","","","225","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 225 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007303","5.8077","","15.1563","","6.2186","","90","","116.408","","90","","490.262","","","","250","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 250 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007304","5.8091","","15.1656","","6.2259","","90","","116.407","","90","","491.261","","","","275","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 275 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007305","5.8105","","15.1758","","6.2337","","90","","116.405","","90","","492.335","","","","300","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 300 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007306","5.8119","","15.1867","","6.2416","","90","","116.405","","90","","493.432","","","","325","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 325 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007307","5.8132","","15.1973","","6.2497","","90","","116.406","","90","","494.523","","","","350","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 350 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007308","5.8145","","15.2086","","6.258","","90","","116.408","","90","","495.65","","","","375","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 375 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007309","5.8151","","15.2179","","6.2664","","90","","116.413","","90","","496.649","","","","400","","","","","","","","","4","I 1 a 1","I -2ya","9","","","Brushite (deuterated)","- Ca D5 O6 P -","- Ca D5 O6 P -","- Ca4 D20 O24 P4 -","4","1","","Schofield, P. F.; Knight, K. S.; van der Houwen, J. A. M.; Valsami-Jones E","The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate Sample: T = 400 K","Physics and Chemistry of Minerals","2004","31","","606","624","10.1007/s00269-004-0419-6","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9007310","8.3329","","8.3329","","8.3329","","90","","90","","90","","578.613","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Mg O4 -","- Cr2 Mg O4 -","- Cr16 Mg8 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: MgCr5","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007311","8.3328","","8.3328","","8.3328","","90","","90","","90","","578.593","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Mg O4 -","- Cr2 Mg O4 -","- Cr16 Mg8 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: MgCr9A","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007312","8.334","","8.334","","8.334","","90","","90","","90","","578.843","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr1.992 Fe0.024 Mg0.984 O4 -","- Cr1.992 Fe0.024 Mg0.984 O4 -","- Cr15.936 Fe0.192 Mg7.872 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-20","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007313","8.3352","","8.3352","","8.3352","","90","","90","","90","","579.093","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr1.996 Fe0.072 Mg0.932 O4 -","- Cr1.996 Fe0.072 Mg0.932 O4 -","- Cr15.968 Fe0.576 Mg7.456 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-10","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007314","8.3379","","8.3379","","8.3379","","90","","90","","90","","579.656","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Fe0.13 Mg0.87 O4 -","- Cr2 Fe0.13 Mg0.87 O4 -","- Cr16 Fe1.04 Mg6.96 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-10B","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007315","8.3415","","8.3415","","8.3415","","90","","90","","90","","580.407","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Fe0.2 Mg0.8 O4 -","- Cr2 Fe0.2 Mg0.8 O4 -","- Cr16 Fe1.6 Mg6.4 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-30","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007316","8.3462","","8.3462","","8.3462","","90","","90","","90","","581.388","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Fe0.32 Mg0.68 O4 -","- Cr2 Fe0.32 Mg0.68 O4 -","- Cr16 Fe2.56 Mg5.44 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-50","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007317","8.349","","8.349","","8.349","","90","","90","","90","","581.974","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Fe0.33 Mg0.67 O4 -","- Cr2 Fe0.33 Mg0.67 O4 -","- Cr16 Fe2.64 Mg5.36 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-40","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007318","8.3465","","8.3465","","8.3465","","90","","90","","90","","581.451","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Fe0.37 Mg0.63 O4 -","- Cr2 Fe0.37 Mg0.63 O4 -","- Cr16 Fe2.96 Mg5.04 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-20B","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007319","8.3577","","8.3577","","8.3577","","90","","90","","90","","583.795","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.6 Mg0.4 O4 -","- Cr2 Fe0.6 Mg0.4 O4 -","- Cr16 Fe4.8 Mg3.2 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-45","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007320","8.362","","8.362","","8.362","","90","","90","","90","","584.696","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.65 Mg0.35 O4 -","- Cr2 Fe0.65 Mg0.35 O4 -","- Cr16 Fe5.2 Mg2.8 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-60","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007321","8.3613","","8.3613","","8.3613","","90","","90","","90","","584.55","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.67 Mg0.33 O4 -","- Cr2 Fe0.67 Mg0.33 O4 -","- Cr16 Fe5.36 Mg2.64 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-55","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007322","8.3672","","8.3672","","8.3672","","90","","90","","90","","585.788","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.76 Mg0.24 O4 -","- Cr2 Fe0.76 Mg0.24 O4 -","- Cr16 Fe6.08 Mg1.92 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-70","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007323","8.371","","8.371","","8.371","","90","","90","","90","","586.586","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.87 Mg0.13 O4 -","- Cr2 Fe0.87 Mg0.13 O4 -","- Cr16 Fe6.96 Mg1.04 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-80","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007324","8.3739","","8.3739","","8.3739","","90","","90","","90","","587.196","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe0.91 Mg0.09 O4 -","- Cr2 Fe0.91 Mg0.09 O4 -","- Cr16 Fe7.28 Mg0.72 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-90","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007325","8.3765","","8.3765","","8.3765","","90","","90","","90","","587.743","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Chromite","- Cr2 Fe O4 -","- Cr2 Fe O4 -","- Cr16 Fe8 O32 -","8","0.0416667","","Lenaz, D.; Skogby, H.; Princivalle, F.; Halenius, U.","Structural changes and valence states in the MgCr2O4-FeCr2O4 solid solution series Sample: Fe2-","Physics and Chemistry of Minerals","2004","31","","633","642","10.1007/s00269-004-0420-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007326","8.79182","","13.11084","","7.20473","","90","","116.097","","90","","745.809","","","","11","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Buddingtonite (deuterated)","- Al D4 N O8 Si3 -","- Al D4 N O8 Si3 -","- Al4 D16 N4 O32 Si12 -","4","0.5","","Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E.","Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 11 K","Physics and Chemistry of Minerals","2004","31","","643","649","10.1007/s00269-004-0425-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007327","8.81611","","13.09609","","7.20155","","90","","116.121","","90","","746.546","","","","210","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Buddingtonite (deuterated)","- Al D4 N O8 Si3 -","- Al D4 N O8 Si3 -","- Al4 D16 N4 O32 Si12 -","4","0.5","","Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E.","Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 210 K","Physics and Chemistry of Minerals","2004","31","","643","649","10.1007/s00269-004-0425-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007328","8.83157","","13.08541","","7.20024","","90","","116.147","","90","","746.943","","","","280","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Buddingtonite (deuterated)","- Al D4 N O8 Si3 -","- Al D4 N O8 Si3 -","- Al4 D16 N4 O32 Si12 -","4","0.5","","Mookherjee, M.; Redfern, S. A. T.; Swainson, I.; Harlov, D. E.","Low-temperature behaviour of ammonium ion in buddingtonite [N(D/H)4AlSi3O8] from neutron powder diffraction Sample: T = 280 K","Physics and Chemistry of Minerals","2004","31","","643","649","10.1007/s00269-004-0425-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007329","5.6884","","28.9238","","8.2382","","90","","90","","90","","1355.43","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite II","- Fe0.08 Mg9.636 O14 Si2.173 -","- Fe0.08 Mg9.636 O14 Si2.173 -","- Fe0.32 Mg38.544 O56 Si8.692 -","4","0.25","","Smyth, J. R.; Holl, C. M.; Langenhorst, F.; Laustsen, H. M. S.; Rossman, G. R.; Kleppe, A.; McCammon, C. A.; Kawamoto, T.; van Aken, P. A.","Crystal chemistry of wadsleyite II and water in the Earth's interior Sample: 1 Reported formula: Mg1.71 Fe.18 Al.01 H.33 Si.96 O4","Physics and Chemistry of Minerals","2005","31","","691","705","10.1007/s00269-004-0431-x","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007330","5.6896","","29.104","","8.243","","90","","90","","90","","1364.96","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","","Wadsleyite II","- Fe0.338 Mg9.292 O14 Si2.134 -","- Fe0.338 Mg9.292 O14 Si2.134 -","- Fe1.352 Mg37.168 O56 Si8.536 -","4","0.25","","Smyth, J. R.; Holl, C. M.; Langenhorst, F.; Laustsen, H. M. S.; Rossman, G. R.; Kleppe, A.; McCammon, C. A.; Kawamoto, T.; van Aken, P. A.","Crystal chemistry of wadsleyite II and water in the Earth's interior Sample: 2 Reported formula: Mg1.60 Fe.22 Al.01 H.44 Si.97 O4","Physics and Chemistry of Minerals","2005","31","","691","705","10.1007/s00269-004-0431-x","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007331","9.068","","9.068","","4.461","","90","","90","","90","","366.822","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe2.26 Ni0.74 P -","- Fe2.26 Ni0.74 P -","- Fe18.08 Ni5.92 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Acuna","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007332","9.0575","","9.0575","","4.4622","","90","","90","","90","","366.071","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe2.07 Ni0.93 P -","- Fe2.07 Ni0.93 P -","- Fe16.56 Ni7.44 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Carlton","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007333","9.047","","9.047","","4.46","","90","","90","","90","","365.043","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe1.88 Ni1.12 P -","- Fe1.88 Ni1.12 P -","- Fe15.04 Ni8.96 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Hex River Mts cl#1","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007334","9.051","","9.051","","4.462","","90","","90","","90","","365.53","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe1.98 Ni1.02 P -","- Fe1.98 Ni1.02 P -","- Fe15.84 Ni8.16 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Hex River Mts cl#2","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007335","9.04","","9.04","","4.462","","90","","90","","90","","364.642","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe1.79 Ni1.21 P -","- Fe1.79 Ni1.21 P -","- Fe14.32 Ni9.68 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Hex River Mts cl#3","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007336","9.06","","9.06","","4.4598","","90","","90","","90","","366.076","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe2.1 Ni0.9 P -","- Fe2.1 Ni0.9 P -","- Fe16.8 Ni7.2 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Odessa cl#1","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007337","9.0375","","9.0375","","4.4601","","90","","90","","90","","364.285","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe1.75 Ni1.25 P -","- Fe1.75 Ni1.25 P -","- Fe14 Ni10 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Odessa cl#2","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007338","9.075","","9.075","","4.464","","90","","90","","90","","367.636","","","","","","","","","","","","","3","I -4","I -4","82","","","Schreibersite","- Fe2.43 Ni0.57 P -","- Fe2.43 Ni0.57 P -","- Fe19.44 Ni4.56 P8 -","8","1","","Skala, R.; Cisarova, I.","Crystal structure of meteoritic schreibersites: determination of absolute structure Sample: Sikhote-Alin","Physics and Chemistry of Minerals","2005","31","","721","732","10.1007/s00269-004-0435-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007602","13.654","","13.654","","14.041","","90","","90","","120","","2266.98","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","","Paratacamite","- Cl Cu2 H3 O3 -","- Cl Cu2 H3 O3 -","- Cl24 Cu48 H72 O72 -","24","1.33333","","Fleet, M. E.","The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Ordered structure, considered to be the true structure","Acta Crystallographica, Section B","1975","31","","183","187","10.1107/S0567740875002324","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9007603","6.827","","6.827","","14.041","","90","","90","","120","","566.746","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","","Paratacamite","- Cl Cu2 H3 O3 -","- Cl Cu2 H3 O3 -","- Cl6 Cu12 H18 O18 -","6","0.333333","","Fleet, M. E.","The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, can be considered as the average structure","Acta Crystallographica, Section B","1975","31","","183","187","10.1107/S0567740875002324","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007604","6.827","","6.827","","14.041","","90","","90","","120","","566.746","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","","Paratacamite","- Cl Cu2 O3 -","- Cl Cu2 O3 -","- Cl6 Cu12 O18 -","6","0.333333","","Fleet, M. E.","The crystal structure of paratacamite, Cu2(OH)3Cl Sample: Substructure, with disordered oxygens","Acta Crystallographica, Section B","1975","31","","183","187","10.1107/S0567740875002324","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007605","10.325","","8.953","","10.038","","90","","90","","90","","927.91","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","Scorodite","- As Fe H4 O6 -","- As Fe H4 O6 -","- As8 Fe8 H32 O48 -","8","1","","Kitahama, K.; Kiriyama, R.; Yoshihisa, B.","Refinement of the crystal structure of scorodite","Acta Crystallographica, Section B","1975","31","","322","324","10.1107/S056774087500266X","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9007606","20.645","","8.383","","6.442","","90","","90","","90","","1114.9","","","","","","","","","","","","Synthetic","3","F d d 2","F 2 -2d","43","","","Blossite","- Cu2 O7 V2 -","- Cu2 O7 V2 -","- Cu16 O56 V16 -","8","0.5","","Calvo, C.; Faggiani, R.","Alpha cupric divanadate","Acta Crystallographica, Section B","1975","31","","603","605","10.1107/S0567740875003354","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007607","8.6377","","8.6377","","11.849","","90","","90","","120","","765.612","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","Takedaite","- B2 Ca3 O6 -","- B2 Ca3 O6 -","- B12 Ca18 O36 -","6","0.166667","","Vegas, A.; Cano, F. H.; Garcia-Blanco S","The crystal structure of calcium orthoborate: a redetermination","Acta Crystallographica, Section B","1975","31","","1416","1419","10.1107/S0567740875005316","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007608","5.807","","12.656","","5.517","","90","","108.32","","90","","384.912","","","","","","","","","","","","Chuquicamata, Chile","5","P 1 21/c 1","-P 2ybc","14","","","Krohnkite","- Cu H4 Na2 O10 S2 -","- Cu H4 Na2 O10 S2 -","- Cu2 H8 Na4 O20 S4 -","2","0.5","","Hawthorne, F. C.; Ferguson, R. B.","Refinement of the crystal structure of krohnkite","Acta Crystallographica, Section B","1975","31","","1753","1755","10.1107/S0567740875006048","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9007609","11.1519","","11.1519","","11.1519","","90","","90","","90","","1386.91","","","","","","","","","","","","Synthetic","2","F d -3 m :1","F 4d 2 3 -1d","227","","","Senarmontite","- O3 Sb2 -","- O3 Sb2 -","- O48 Sb32 -","16","0.0833333","","Svensson, C.","Refinement of the crystal structure of cubic antiomony trioxide, Sb2O3","Acta Crystallographica, Section B","1975","31","","2016","2018","10.1107/S0567740875006759","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007610","7.621","","11.761","","6.731","","92.767","","95.083","","106.867","","573.345","","","","","","","","","","","","","5","P -1","-P 1","2","","","Nambulite","- Li0.55 Mn4 Na0.45 O15 Si5 -","- Li0.55 Mn4 Na0.45 O15 Si5 -","- Li1.1 Mn8 Na0.9 O30 Si10 -","2","1","","Narita, H.; Koto, K.; Morimoto, N.; Yoshii, M.","The crystal structure of nambulite (Li,Na)Mn4Si5O14(OH)","Acta Crystallographica, Section B","1975","31","","2422","2426","10.1107/S056774087500773X","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9009614","5.894","","16.116","","4.612","","90","","106.54","","90","","419.956","","","","","","","","","","","","Mountain Pass mine, San Bernardino County, California","6","P 1 21/a 1","-P 2yab","14","","","Sahamalite-(Ce)","- C4 Ce Fe0.14 La Mg0.86 O12 -","- C4 Ce Fe0.14 La Mg0.86 O12 -","- C8 Ce2 Fe0.28 La2 Mg1.72 O24 -","2","0.5","","Pertlik, F.; Preisinger, A.","Crystal structure of sahamalite (Mg,Fe)RE2(CO3)4","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","39","46","10.1007/BF01084760","","","","","","","","","","","","","","","","","","","","","has coordinates","288653","2024-01-03","17:00:04",""
"9009615","10.46","","10.46","","45.479","","90","","90","","120","","4309.28","","","","","","","","","","","","Tunugdliarfik, South Greenland","11","R -3 m :H","-R 3 2""","166","","","Steenstrupine-(Ce)","- Ca0.52 Ce3.9 Fe2 H10 La2.1 Mn2 Na13.48 O68.2 P5.44 Si13.38 Zr -","- Ca0.52 Ce3.9 Fe2 H6.38 La2.1 Mn2 Na13.48 O67.47 P5.44 Si13.38 Zr -","- Ca1.56 Ce11.7 Fe6 H19.14 La6.3 Mn6 Na40.44 O202.41 P16.32 Si40.14 Zr3 -","3","0.0833333","","Moore, P. B.; Shen, J.","Crystal structure of steenstrupine: A rod structure of unusual complexity","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","47","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:26",""
"9009616","7.25","","7.474","","6.909","","105.59","","112.81","","99.28","","317.198","","","","","","","","","","","","Synthetic","4","P -1","-P 1","2","","","Davanite","- K2 O15 Si6 Ti -","- K2 O15 Si6 Ti -","- K2 O15 Si6 Ti -","1","0.5","","Gebert, W.; Medenbach, O.; Florke, O. W.","Darstellung und kristallographie von K2TiSi6O15 - isotyp mit dalyit K2ZrSi6O15 Locality: synthetic","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","69","79","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009911","5.9718","","3.8621","","6.3242","","90","","90","","90","","145.859","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Rh Sb -","- Rh Sb -","- Rh4 Sb4 -","4","0.5","","Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F.","On the MnP type structure of RuSb and RhSb","Acta Chemica Scandinavica A","1977","31","","249","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009912","5.9608","","3.7023","","6.5797","","90","","90","","90","","145.205","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Ru Sb -","- Ru Sb -","- Ru4 Sb4 -","4","0.5","","Endresen, K.; Furuseth, S.; Selte, K.; Kjekshus, A.; Rakke, T.; Andresen, A. F.","On the MnP type structure of RuSb and RhSb","Acta Chemica Scandinavica A","1977","31","","249","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009913","5.1169","","5.8915","","2.8709","","90","","90","","90","","86.547","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- P2 Ru -","- P2 Ru -","- P4 Ru2 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009914","5.4279","","6.1834","","2.9685","","90","","90","","90","","99.631","","","","","","","","","","","","Synthetic","2","P n n m","-P 2 2n","58","","","Anduoite","- As2 Ru -","- As2 Ru -","- As4 Ru2 -","2","0.25","","RuAs2; Kjekshus A; Rakke T; Andresen A F","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009915","5.9514","","6.6743","","3.179","","90","","90","","90","","126.274","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Ru Sb2 -","- Ru Sb2 -","- Ru2 Sb4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009916","5.1012","","5.9022","","2.9183","","90","","90","","90","","87.865","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Os P2 -","- Os P2 -","- Os2 P4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009917","5.4115","","6.19","","3.0127","","90","","90","","90","","100.917","","","","","","","","","","","","Synthetic","2","P n n m","-P 2 2n","58","","","Omeiite","- As2 Os -","- As2 Os -","- As4 Os2 -","2","0.25","","OsAs2; Kjekshus A; Rakke T; Andresen A F","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2 Locality: synthetic","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009918","5.9411","","6.6873","","3.2109","","90","","90","","90","","127.569","","","","","","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Os Sb2 -","- Os Sb2 -","- Os2 Sb4 -","2","0.25","","Kjekshus, A.; Rakke, T.; Andresen, A. F.","Compounds with the marcasite type crystal structure. XII. Structural data for RuP2, RuAs2, RuSb2, OsP2, OsAs2, and OsSb2","Acta Chemica Scandinavica A","1977","31","","253","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9011152","8.412","","9.8","","18.957","","90","","90","","90","","1562.77","","","","","","","","","","","","Synthetic","4","P b c a","-P 2ac 2ab","61","","","Mercallite","- H K O4 S -","- H K O4 S -","- H16 K16 O64 S16 -","16","2","","Cotton, F. A.; Frenz, B. A.; Hunter, D. L.","The structure of potassium hydrogensulfate Note: y(O23), z(H1), x(H2) corrected","Acta Crystallographica, Section B","1975","31","","302","304","10.1107/S0567740875002580","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:26:22",""
"9011153","6.472","","10.724","","5.259","","90","","90","","90","","365.005","","","","","","","","","","","","Synthetic","4","P 21 a b","P -2b 2a","29","","","Thermonatrite","- C H2 Na2 O4 -","- C H2 Na2 O4 -","- C4 H8 Na8 O16 -","4","1","","Wu, K. K.; Brown, I. D.","A neutron diffraction study of Na2CO3*H2O","Acta Crystallographica, Section B","1975","31","","890","892","10.1107/S0567740875004001","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011154","10.629","","18.339","","5.04","","90","","90","","90","","982.423","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Hopeite","- H8 O12 P2 Zn3 -","- H8 O12 P2 Zn3 -","- H32 O48 P8 Zn12 -","4","0.5","","Whitaker, A.","The crystal structure of hopeite, Zn3(PO4)2*4H2O","Acta Crystallographica, Section B","1975","31","","2026","2035","10.1107/S0567740875006784","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9011155","6.59","","6.59","","17.04","","90","","90","","90","","740.015","","","","","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- O9 S2 Sb2 -","- O9 S2 Sb2 -","- O36 S8 Sb8 -","4","0.5","","Mercier, R.; Douglade, J.; Theobald, F. R.","Structure cristalline de Sb2O3*2SO3","Acta Crystallographica, Section B","1975","31","","2081","2085","10.1107/S0567740875006899","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011156","10.705","","10.734","","31.63","","90","","90","","90","","3634.52","","","","","","","","","","","","Lydenburg District, Transvaal, South Africa","3","P 2 2 2","P 2 2","16","","","Haycockite","- Cu4 Fe5 S8 -","- Cu4 Fe5 S8 -","- Cu48 Fe60 S96 -","12","3","","Rowland, J. F.; Hall, S. R.","Haycockite, Cu4Fe5S8: a superstructure in the chalcopyrite series","Acta Crystallographica, Section B","1975","31","","2105","2112","10.1107/S0567740875006929","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011157","10.95","","21.862","","10.95","","90","","90","","90","","2621.31","","","","","","","","","","","","Cornwall, England","3","P b c a","-P 2ac 2ab","61","","","Bornite","- Cu2.5 Fe0.5 S2 -","- Cu2.49999 Fe0.50001 S2 -","- Cu79.9997 Fe16.0003 S64 -","32","4","","Koto, K.; Morimoto, N.","Superstructure investigation of bornite, Cu5FeS4, by the modified partial Patterson function","Acta Crystallographica, Section B","1975","31","","2268","2273","10.1107/S0567740875007376","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9011158","12.015","","6.518","","11.173","","90","","90","","90","","875","","","","","","","","","","","","Synthetic","4","P n a 21","P 2c -2n","33","","","Nasinite","- B5 H5 Na2 O11 -","- B5 H5 Na2 O11 -","- B20 H20 Na8 O44 -","4","1","","Corazza, E.; Menchetti, S.; Sabelli, C.","The crystal structure of nasinite, Na2[B5O8(OH)]*2H2O","Acta Crystallographica, Section B","1975","31","","2405","2410","10.1107/S0567740875007704","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9011773","8.783","","15.432","","8.252","","90","","90","","90.09","","1118.47","","","","","","","","","","","","Synthetic","4","P 1 1 21/n","-P 2n","14","","","","- Al Ge Na O4 -","- Al Ge Na O4 -","- Al12 Ge12 Na12 O48 -","12","3","","Sandomirskii, P. A.; Meshalkin, S. S.; Rozhdestvenskaya, I. V.; Dem'yanets, L. N.; Uvarova, T. G.","Crystal structures of the D-phase of K(AlGeO4) and the C-phase of Na(AlGeO4) to match reported bond lengths Note: z coordinate of O8 changed from .05135 to .15135 to match reported bond lengths Note: y coordinate of O11 changed from .04154 to .05154 to match reported bond lengths","Kristallografiya","1986","31","","522","527","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011774","18.429","","18.429","","8.599","","90","","90","","120","","2529.19","","","","","","","","","","","","Synthetic","4","P 63","P 6c","173","","","","- Al Ge K O4 -","- Al Ge K O4 -","- Al24 Ge24 K24 O96 -","24","4","","Sandomirskii, P. A.; Meshalkin, S. S.; Rozhdestvenskaya, I. V.; Dem'yanets, L. N.; Uvarova, T. G.","Crystal structures of the D-phase of K(AlGeO4) and the C-phase of Na(AlGeO4) match reported bond lengths Note: z coordinate of O23 changed from .2859 to .2598 to match reported bond lengths Note: y coordinate of O31 changed from .5328 to .5388 to match reported bond lengths","Kristallografiya","1986","31","","522","527","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011881","8.7","","8.728","","11.688","","94.31","","98.62","","105.62","","838.839","","","","","","","","","","","","","11","P 1","P 1","1","","","Murmanite","- Ca0.6 Fe0.6 H16 K0.2 Mn0.45 Na4.5 Nb0.8 O44 Si8 Ti6.6 Zr0.25 -","- Ca0.6 Fe0.6 H16 K0.2 Mn0.45 Na4.5 Nb0.8 O44 Si8 Ti6.6 Zr0.25 -","- Ca0.6 Fe0.6 H16 K0.2 Mn0.45 Na4.5 Nb0.8 O44 Si8 Ti6.6 Zr0.25 -","1","1","","Rastsvetaeva, R. K.; Andrianov, V. I.","New data on the crystal structure of murmanite","Soviet Physics Crystallography","1986","31","","44","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011905","8.606","","8.672","","4.317","","102.79","","97.94","","116.66","","270.162","","","","","","","","","","","","Kola Peninsula, Russia","6","P 1","P 1","1","","","Kuliokite-(Y)","- Al F5 H2 O10 Si2 Y4 -","- Al F5 H2 O10 Si2 Y4 -","- Al F5 H2 O10 Si2 Y4 -","1","1","","Sokolova, E. V.; Egorov-Tismenko Y K; Voloshin, A. V.; Pakhomovsky, Y. A.","Crystal structure of the new Y-Al silicate kuliokite-(Y), Y4Al[SiO4]2(OH)2F5","Soviet Physics Doklady","1986","31","","601","603","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9011906","4.715","","8.87","","6.805","","90","","102.01","","90","","278.37","","","","","","","","","","","","Kola Peninsula, Russia","9","A 1 2/m 1","-A 2y","12","","","Keiviite-(Yb)","- Dy0.04 Er0.16 Ho0.02 Lu0.22 O7 Si2 Tm0.08 Y0.06 Yb1.42 -","- Dy0.04 Er0.16 Ho0.02 Lu0.22 O7 Si2 Tm0.08 Y0.06 Yb1.42 -","- Dy0.08 Er0.32 Ho0.04 Lu0.44 O14 Si4 Tm0.16 Y0.12 Yb2.84 -","2","0.25","","Yakubovich, O. V.; Simonov, M. A.; Voloshin, A. V.; Pakhomovsky, Y. A.","Crystal structure of keivite Yb2[Si2O7]","Soviet Physics Doklady","1986","31","","930","932","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011907","15.197","","10.233","","8.435","","90","","90.31","","90","","1311.71","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","Lithosite","- Al2 K3 O13 Si4 -","- Al2 K3 O13 Si4 -","- Al8 K12 O52 Si16 -","4","2","","Pudovkina, Z. V.; Solov'eva, L. P.; Pyatenko, Y. A.","Crystal structure of lithosite K3[HAl2Si4O13]","Soviet Physics Doklady","1986","31","","941","942","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011958","6.948","","14.089","","14.065","","90","","90","","90","","1376.83","","","","","","","","","","","","","6","P b c b","-P 2bc 2b","54","","","Tancoite","- Al H2 Li Na2 O9 P2 -","- Al H2 Li Na2 O9 P2 -","- Al8 H16 Li8 Na16 O72 P16 -","8","1","","Hawthorne, F. C.","The crystal structure of tancoite","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","121","135","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011959","11.458","","5.052","","8.84","","90","","108.91","","90","","484.093","","","","","","","","","","","","Synthetic","6","P 1 21/a 1","-P 2yab","14","","","Reinhardbraunsite","- Ca5 F0.97 H1.26 O9.26 P0.04 Si1.96 -","- Ca5 F0.97 H1.26 O9.26 P0.04 Si1.96 -","- Ca10 F1.94 H2.52 O18.52 P0.08 Si3.92 -","2","0.5","","Kirfel, A.; Hamm, H. M.; Will, G.","The crystal structure of reinhardbraunsite, Ca5(SiO4)2(OH,F)2, a new mineral of the calcio-chondrodite type","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","137","150","10.1007/BF01084766","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011966","5.782","","5.782","","12.629","","90","","90","","120","","365.642","","","","","","","","","","","","","3","P 63 2 2","P 6c 2c","182","","","","- Mn0.98 Nb3 S6 -","- Mn0.98 Nb3 S6 -","- Mn1.96 Nb6 S12 -","2","0.166667","","Anzenhofer, K.; van den Berg, J. M.; Cossee, P.; Helle, J. N.","The crystal structures and magnetic susceptibilities of MnNb3S6, FeNb3S6, CoNb3S6 and NiNb3S6","Journal of Physics and Chemistry of Solids","1970","31","","1057","1067","10.1016/0022-3697(70)90315-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011967","5.768","","5.768","","11.886","","90","","90","","120","","342.466","","","","","","","","","","","","","3","P 63 2 2","P 6c 2c","182","","","","- Nb3 Ni S6 -","- Nb3 Ni S6 -","- Nb6 Ni2 S12 -","2","0.166667","","Anzenhofer, K.; van den Berg, J. M.; Cossee, P.; Helle, J. N.","The crystal structures and magnetic susceptibilities of MnNb3S6, FeNb3S6, CoNb3S6 and NiNb3S6","Journal of Physics and Chemistry of Solids","1970","31","","1057","1067","10.1016/0022-3697(70)90315-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011968","5.768","","5.768","","11.886","","90","","90","","120","","342.466","","","","","","","","","","","","","3","P 63 2 2","P 6c 2c","182","","","","- Co0.95 Nb3 S6 -","- Co0.95 Nb3 S6 -","- Co1.9 Nb6 S12 -","2","0.166667","","Anzenhofer, K.; van den Berg, J. M.; Cossee, P.; Helle, J. N.","The crystal structures and magnetic susceptibilities of MnNb3S6, FeNb3S6, CoNb3S6 and NiNb3S6","Journal of Physics and Chemistry of Solids","1970","31","","1057","1067","10.1016/0022-3697(70)90315-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011969","5.761","","5.761","","12.201","","90","","90","","120","","350.689","","","","","","","","","","","","Synthetic","3","P 63 2 2","P 6c 2c","182","","","Edgarite","- Fe Nb3 S6 -","- Fe Nb3 S6 -","- Fe2 Nb6 S12 -","2","0.166667","","Anzenhofer, K.; van den Berg, J. M.; Cossee, P.; Helle, J. N.","The crystal structures and magnetic susceptibilities of MnNb3S6, FeNb3S6, CoNb3S6 and NiNb3S6","Journal of Physics and Chemistry of Solids","1970","31","","1057","1067","10.1016/0022-3697(70)90315-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9012067","10.2573","","13.4211","","4.7526","","90","","105.076","","90","","631.744","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","Hornesite","- As2 H16 Mg2.484 Ni0.516 O16 -","- As2 H16 Mg2.484 Ni0.516 O16 -","- As4 H32 Mg4.968 Ni1.032 O32 -","2","0.25","","Rojo, J. M.; Mesa, J. L.; Pizarro, J. L.; Lezama, L.; Arriortua, M. I.; Rojo, T.","Spectroscopic and magnetic study of the (Mg,M)3(AsO4)2*8H2O (M = Ni2+, Co2+) arsenates Note: z(Wat2) corrected","Materials Research Bulletin","1996","31","","925","934","10.1016/S0025-5408(96)00088-8","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9012518","6.264","","6.264","","13.428","","90","","90","","90","","526.884","","","","","","","","","","","","Synthetic","4","I 4/m m m","-I 4 2","139","","","","- Co O14 P2 V2 -","- Co O14 P2 V2 -","- Co2 O28 P4 V4 -","2","0.0625","","Kang, H. Y.; Lee, W. C.; Wang, S. L.","Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb)","Inorganic Chemistry","1992","31","","4743","4748","10.1021/ic00049a007","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012519","6.3484","","6.35","","6.597","","106.81","","94.09","","90.02","","253.867","","","","","","","","","","","","Synthetic","5","P 1","P 1","1","","","Sincosite","- Ca H8 O14 P2 V2 -","- Ca H8 O14 P2 V2 -","- Ca H8 O14 P2 V2 -","1","1","","Kang, H. Y.; Lee, W. C.; Wang, S. L.","Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb)","Inorganic Chemistry","1992","31","","4743","4748","10.1021/ic00049a007","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012520","9.026","","9.01","","12.841","","90","","100.19","","90","","1027.81","","","","","","","","","","","","Synthetic","5","C 1 c 1","C -2yc","9","","","","- H8 O14 P2 Sr V2 -","- H8 O14 P2 Sr V2 -","- H32 O56 P8 Sr4 V8 -","4","1","","Kang, H. Y.; Lee, W. C.; Wang, S. L.","Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb)","Inorganic Chemistry","1992","31","","4743","4748","10.1021/ic00049a007","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012521","9.03","","9.021","","12.874","","90","","100.16","","90","","1032.27","","","","","","","","","","","","Synthetic","5","C 1 c 1","C -2yc","9","","","","- H6 O14 P2 Pb V2 -","- H6 O14 P2 Pb V2 -","- H24 O56 P8 Pb4 V8 -","4","1","","Kang, H. Y.; Lee, W. C.; Wang, S. L.","Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb)","Inorganic Chemistry","1992","31","","4743","4748","10.1021/ic00049a007","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012563","16.756","","3.6391","","8.023","","90","","111.18","","90","","456.17","","","","","","","","","","","","Synthetic","4","P 1 21/a 1","-P 2yab","14","","","Munirite","- H3.78 Na O4.89 V -","- H2.89 Na O4.89 V -","- H11.56 Na4 O19.56 V4 -","4","1","","Bjornberg, A.; Hedman, B.","The crystal structure of NaVO3*1.89H2O Note: one of the H atoms could not be found","Acta Chemica Scandinavica A","1977","31","","579","584","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9012597","13.706","","9.924","","7.024","","90","","90","","90","","955.393","","","","","","","","","","","","Synthetic","5","P n m a","-P 2ac 2n","62","","","Kremersite","- Cl5 Fe H10 N2 O -","- Cl5 Fe H10 N2 O -","- Cl20 Fe4 H40 N8 O4 -","4","0.5","","Figgis, B. N.; Raston, C. L.; Sharma, R. P.; White, A. H.","Crystal structure of diammonium aquapentachloroferrate(III)","Australian Journal of Chemistry","1978","31","","2717","2720","10.1071/CH9782717","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9013006","3.65","","4.47","","11","","90","","90","","90","","179.471","","","","","","","","","","","","","1","B m a b","-B 2ab 2","64","","","Arsenolamprite","- As -","- As -","- As8 -","8","","","Smith, P. M.; Leadbetter, A. J.; Apling, A. J.","The structures of orthorhombic and vitrous arsenic Locality: synthetic Note: known as arsenolamprite","Philosophical Magazine","1975","31","","57","64","10.1080/14786437508229285","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013124","3.965","","3.965","","3.091","","90","","90","","120","","42.084","","","","","","","","66000000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 66 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013125","3.937","","3.937","","3.044","","90","","90","","120","","40.861","","","","","","","","76900000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 76.9 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013126","3.908","","3.908","","2.985","","90","","90","","120","","39.481","","","","","","","","86200000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 86.2 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013127","3.892","","3.892","","2.9572","","90","","90","","120","","38.793","","","","","","","","87900000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 87.9 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013128","3.8704","","3.8704","","2.9123","","90","","90","","120","","37.781","","","","","","","","101300000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 101.3 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013129","3.834","","3.834","","2.848","","90","","90","","120","","36.256","","","","","","","","110000000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 110 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013130","3.829","","3.829","","2.791","","90","","90","","120","","35.437","","","","","","","","120000000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 120 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013131","3.838","","3.838","","2.695","","90","","90","","120","","34.379","","","","","","","","130000000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 130 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013132","3.85","","3.85","","2.645","","90","","90","","120","","33.953","","","","","","","","140000000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 140 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013133","3.844","","3.844","","2.635","","90","","90","","120","","33.719","","","","","","","","142500000","","","","Synthetic","1","R -3 m :H","-R 3 2""","166","Selenium","","Selenium","- Se -","- Se -","- Se3 -","3","0.0833333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 142.5 GPa Note: structure known as beta-Po type, phase Se V","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013134","2.822","","2.822","","2.822","","90","","90","","90","","22.474","","","","","","","","140000000","","","","Synthetic","1","I m -3 m","-I 4 2 3","229","Selenium","","Selenium","- Se -","- Se -","- Se2 -","2","0.0208333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 140 GPa Note: structure known as bcc, phase Se VI","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013135","2.8159","","2.8159","","2.8159","","90","","90","","90","","22.328","","","","","","","","142500000","","","","Synthetic","1","I m -3 m","-I 4 2 3","229","Selenium","","Selenium","- Se -","- Se -","- Se2 -","2","0.0208333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 142.5 GPa Note: structure known as bcc, phase Se VI","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013136","2.8076","","2.8076","","2.8076","","90","","90","","90","","22.131","","","","","","","","146500000","","","","Synthetic","1","I m -3 m","-I 4 2 3","229","Selenium","","Selenium","- Se -","- Se -","- Se2 -","2","0.0208333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 146.5 GPa Note: structure known as bcc, phase Se VI","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013137","2.7941","","2.7941","","2.7941","","90","","90","","90","","21.814","","","","","","","","150000000","","","","Synthetic","1","I m -3 m","-I 4 2 3","229","Selenium","","Selenium","- Se -","- Se -","- Se2 -","2","0.0208333","","Akahama, Y.; Kobayashi, M.; Kawamura, H.","Structural study on pressure-induced phase transition from beta-Po type to bcc in selenium at 140 GPa Locality: synthetic Sample: at P = 150 GPa Note: structure known as bcc, phase Se VI","Japanese Journal of Applied Physics","1992","31","","1621","1624","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013738","7.8628","","16.6128","","5.65004","","90","","90.093","","90","","738.025","","","","","","","","","","","","Black Mountains, New Hampshire, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.53 Fe0.768 Li0.1 Mg0.05 O12 Si1.91 -","- Al4.53 Fe0.7675 Li0.1 Mg0.05 O12 Si1.91 -","- Al18.12 Fe3.07 Li0.4 Mg0.2 O48 Si7.64 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 71-62R/1 Locality: Black Mountains, New Hampshire, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013739","7.8633","","16.6118","","5.6505","","90","","90.139","","90","","738.086","","","","","","","","","","","","Black Mountains, New Hampshire, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.507 Fe0.778 Li0.1 Mg0.04 O12 Si1.92 -","- Al4.5075 Fe0.7775 Li0.1 Mg0.04 O12 Si1.92 -","- Al18.03 Fe3.11 Li0.4 Mg0.16 O48 Si7.68 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 71-62R/6 Locality: Black Mountains, New Hampshire, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013740","7.8647","","16.6081","","5.6511","","90","","90.226","","90","","738.128","","","","","","","","","","","","Black Mountains, New Hampshire, USA","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.495 Fe0.781 H1.04 Li0.1 Mg0.056 O12 Si1.92 -","- Al4.495 Fe0.7815 H1.04 Li0.1 Mg0.056 O12 Si1.92 -","- Al17.98 Fe3.126 H4.16 Li0.4 Mg0.224 O48 Si7.68 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 71-62R/5 Locality: Black Mountains, New Hampshire, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013741","7.8787","","16.6243","","5.6611","","90","","90.004","","90","","741.479","","","","","","","","","","","","Emery Hill, New York, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.39 Fe0.76 Mg0.385 O12 Si1.93 Zn0.015 -","- Al4.39 Fe0.76 Mg0.385 O12 Si1.93 Zn0.015 -","- Al17.56 Fe3.04 Mg1.54 O48 Si7.72 Zn0.06 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: EH-6/6 Locality: Emery Hill, New York, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013742","7.8831","","16.6225","","5.6602","","90","","90.012","","90","","741.695","","","","","","","","","","","","Emery Hill, New York, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.365 Fe0.765 Mg0.425 O12 Si1.92 Zn0.015 -","- Al4.365 Fe0.765 Mg0.425 O12 Si1.92 Zn0.015 -","- Al17.46 Fe3.06 Mg1.7 O48 Si7.68 Zn0.06 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: EH-6/4 Locality: Emery Hill, New York, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013743","7.881","","16.625","","5.661","","90","","90.056","","90","","741.713","","","","","","","","","","","","Emery Hill, New York, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.35 Fe0.745 Mg0.42 O12 Si1.93 Zn0.015 -","- Al4.35 Fe0.745 Mg0.42 O12 Si1.93 Zn0.015 -","- Al17.4 Fe2.98 Mg1.68 O48 Si7.72 Zn0.06 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: EH-6/2 Locality: Emery Hill, New York, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013744","7.8744","","16.6253","","5.6625","","90","","90.014","","90","","741.302","","","","","","","","","","","","West Sidney, Maine, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.467 Fe0.882 Li0.02 Mg0.213 O12 Si1.92 -","- Al4.4675 Fe0.8825 Li0.02 Mg0.2125 O12 Si1.92 -","- Al17.87 Fe3.53 Li0.08 Mg0.85 O48 Si7.68 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 3-3/1 Locality: West Sidney, Maine, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013745","7.8727","","16.62669","","5.6626","","90","","90.042","","90","","741.217","","","","","","","","","","","","West Sidney, Maine, USA","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.493 Fe0.872 Li0.04 Mg0.173 O12 Si1.91 Zn0.01 -","- Al4.4925 Fe0.8725 Li0.04 Mg0.1725 O12 Si1.91 Zn0.01 -","- Al17.97 Fe3.49 Li0.16 Mg0.69 O48 Si7.64 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 3-3/2 Locality: West Sidney, Maine, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013746","7.8782","","16.6056","","5.6568","","90","","90.084","","90","","740.034","","","","","","","","","","","","Franklin, North Carolina, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.507 Fe0.643 Mg0.285 O12 Si1.87 Zn0.16 -","- Al4.5075 Fe0.6425 Mg0.285 O12 Si1.87 Zn0.16 -","- Al18.03 Fe2.57 Mg1.14 O48 Si7.48 Zn0.64 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 106038/1 Locality: Franklin, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013747","7.8772","","16.606","","5.6568","","90","","90.087","","90","","739.958","","","","","","","","","","","","Franklin, North Carolina, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.529 Fe0.654 Mg0.273 O12 Si1.86 Zn0.162 -","- Al4.529 Fe0.654 Mg0.2725 O12 Si1.86 Zn0.162 -","- Al18.116 Fe2.616 Mg1.09 O48 Si7.44 Zn0.648 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 106038/3 Locality: Franklin, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013748","7.8685","","16.6103","","5.6584","","90","","90.026","","90","","739.542","","","","","","","","","","","","Stratford, North Carolina, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.529 Fe0.654 Mg0.273 O12 Si1.86 Zn0.162 -","- Al4.529 Fe0.654 Mg0.2725 O12 Si1.86 Zn0.162 -","- Al18.116 Fe2.616 Mg1.09 O48 Si7.44 Zn0.648 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 117189/6 Locality: Stratford, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013749","7.8678","","16.6093","","5.6581","","90","","90.128","","90","","739.391","","","","","","","","","","","","Stratford, North Carolina, USA","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.417 Fe0.593 Li0.015 Mg0.196 O12 Si1.92 Zn0.33 -","- Al4.4165 Fe0.593 Li0.015 Mg0.1955 O12 Si1.92 Zn0.33 -","- Al17.666 Fe2.372 Li0.06 Mg0.782 O48 Si7.68 Zn1.32 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 117189/7 Locality: Stratford, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013750","7.8683","","16.6094","","5.6593","","90","","90.271","","90","","739.593","","","","","","","","","","","","Stratford, North Carolina, USA","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.415 Fe0.583 Li0.015 Mg0.195 O12 Si1.92 Zn0.35 -","- Al4.415 Fe0.5825 Li0.015 Mg0.195 O12 Si1.92 Zn0.35 -","- Al17.66 Fe2.33 Li0.06 Mg0.78 O48 Si7.68 Zn1.4 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 117189/21 Locality: Stratford, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013751","7.8691","","16.6064","","5.6595","","90","","90.452","","90","","739.546","","","","","","","","","","","","Stratford, North Carolina, USA","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al8.83 Fe1.165 H1.56 Li0.03 Mg0.39 O24 Si3.84 Zn0.7 -","- Al4.415 Fe0.5825 H0.78 Li0.015 Mg0.195 O12 Si1.92 Zn0.35 -","- Al17.66 Fe2.33 H3.12 Li0.06 Mg0.78 O48 Si7.68 Zn1.4 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 117189/1 Locality: Stratford, North Carolina, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013752","7.8707","","16.5875","","5.6551","","90","","90.025","","90","","738.303","","","","","","","","","","","","East Winthrop, Maine, USA","6","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.492 Fe0.71 Li0.255 Mg0.082 O12 Si1.946 -","- Al4.4915 Fe0.71 Li0.255 Mg0.0825 O12 Si1.946 -","- Al17.966 Fe2.84 Li1.02 Mg0.33 O48 Si7.784 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 6-3/1 Locality: East Winthrop, Maine, USA","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013753","7.8719","","16.6118","","5.6547","","90","","90.122","","90","","739.443","","","","","","","","","","","","Fiordland, New Zealand","5","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.44 Fe0.74 Mg0.347 O12 Si1.92 -","- Al4.44 Fe0.74 Mg0.3475 O12 Si1.92 -","- Al17.76 Fe2.96 Mg1.39 O48 Si7.68 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: WARD/7 Locality: Fiordland, New Zealand","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013754","7.8678","","16.6189","","5.6582","","90","","90","","90","","739.833","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.512 Fe0.898 H0.75 Li0.02 Mg0.169 O12 Si1.86 -","- Al4.5125 Fe0.898 H0.75 Li0.02 Mg0.1695 O12 Si1.86 -","- Al18.05 Fe3.592 H3 Li0.08 Mg0.678 O48 Si7.44 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MOT/2","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013755","7.8682","","16.61499","","5.6553","","90","","90.024","","90","","739.318","","","","","","","","","","","","Pizzo Forno, Switzerland","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.488 Fe0.812 H0.75 Li0.02 Mg0.25 O12 Si1.88 Zn0.015 -","- Al4.4875 Fe0.8125 H0.75 Li0.02 Mg0.25 O12 Si1.88 Zn0.015 -","- Al17.95 Fe3.25 H3 Li0.08 Mg O48 Si7.52 Zn0.06 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MUS/6-1 Locality: Pizzo Forno, Switzerland","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013756","7.866","","16.61378","","5.6552","","90","","90.057","","90","","739.044","","","","","","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.488 Fe0.812 H0.75 Li0.02 Mg0.25 O12 Si1.88 Zn0.015 -","- Al4.4875 Fe0.8125 H0.75 Li0.02 Mg0.25 O12 Si1.88 Zn0.015 -","- Al17.95 Fe3.25 H3 Li0.08 Mg O48 Si7.52 Zn0.06 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MUS-AR/3 Locality: Pizzo Forno, Switzerland","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013757","7.869","","16.6142","","5.6585","","90","","90.07","","90","","739.776","","","","","","","","","","","","Pizzo Forno, Switzerland","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.478 Fe0.829 Li0.025 Mg0.268 O12 Si1.89 Zn0.03 -","- Al4.4785 Fe0.829 Li0.025 Mg0.2675 O12 Si1.89 Zn0.03 -","- Al17.914 Fe3.316 Li0.1 Mg1.07 O48 Si7.56 Zn0.12 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: HP1/2 Locality: Pizzo Forno, Switzerland","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013758","7.8689","","16.6198","","5.6566","","90","","90.164","","90","","739.765","","","","","","","","","","","","Pizzo Forno, Switzerland","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.478 Fe0.819 H0.75 Li0.025 Mg0.268 O12 Si1.89 Zn0.03 -","- Al4.4785 Fe0.819 H0.75 Li0.025 Mg0.2675 O12 Si1.89 Zn0.03 -","- Al17.914 Fe3.276 H3 Li0.1 Mg1.07 O48 Si7.56 Zn0.12 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MUS/3 Locality: Pizzo Forno, Switzerland","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013759","7.8669","","16.6216","","5.6569","","90","","90.03","","90","","739.699","","","","","","","","","","","","Brazil","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.51 Fe0.839 H0.75 Li0.025 Mg0.204 O12 Si1.87 Zn0.02 -","- Al4.51 Fe0.8385 H0.75 Li0.025 Mg0.204 O12 Si1.87 Zn0.02 -","- Al18.04 Fe3.354 H3 Li0.1 Mg0.816 O48 Si7.48 Zn0.08 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: PIO/11 Locality: Brazil","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013760","7.865","","16.60899","","5.656","","90","","90.028","","90","","738.842","","","","","","","","","","","","Brazil","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.495 Fe0.859 H0.75 Li0.023 Mg0.221 O12 Si1.87 Zn0.02 -","- Al4.495 Fe0.859 H0.75 Li0.023 Mg0.221 O12 Si1.87 Zn0.02 -","- Al17.98 Fe3.436 H3 Li0.092 Mg0.884 O48 Si7.48 Zn0.08 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: PIO/13 Locality: Brazil","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013761","7.875","","16.614","","5.658","","90","","90.045","","90","","740.266","","","","","","","","","","","","Antarctica","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.435 Fe0.823 H0.75 Li0.03 Mg0.207 O12 Si1.92 Zn0.05 -","- Al4.435 Fe0.823 H0.75 Li0.03 Mg0.207 O12 Si1.92 Zn0.05 -","- Al17.74 Fe3.292 H3 Li0.12 Mg0.828 O48 Si7.68 Zn0.2 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DW7/4 Locality: Antarctica","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013762","7.8682","","16.6218","","5.6573","","90","","90.104","","90","","739.881","","","","","","","","","","","","Antarctica","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.493 Fe0.796 H0.75 Li0.03 Mg0.188 O12 Si1.9 Zn0.055 -","- Al4.493 Fe0.796 H0.75 Li0.03 Mg0.1885 O12 Si1.9 Zn0.055 -","- Al17.972 Fe3.184 H3 Li0.12 Mg0.754 O48 Si7.6 Zn0.22 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DW7/8II Locality: Antarctica","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013763","7.8682","","16.6218","","5.6573","","90","","90.104","","90","","739.881","","","","","","","","","","","","Derivo, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.48 Fe0.9 Li0.03 Mg0.18 O12 Si1.88 Zn0.01 -","- Al4.48 Fe0.9 Li0.03 Mg0.18 O12 Si1.88 Zn0.01 -","- Al17.92 Fe3.6 Li0.12 Mg0.72 O48 Si7.52 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DER/10-2 Locality: Derivo, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013764","7.8723","","16.62259","","5.6619","","90","","90.114","","90","","740.904","","","","","","","","","","","","Derivo, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.48 Fe0.9 Li0.03 Mg0.18 O12 Si1.88 Zn0.01 -","- Al4.48 Fe0.9 Li0.03 Mg0.18 O12 Si1.88 Zn0.01 -","- Al17.92 Fe3.6 Li0.12 Mg0.72 O48 Si7.52 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DER/2 Locality: Derivo, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013765","7.871","","16.62399","","5.6605","","90","","90.12","","90","","740.66","","","","","","","","","","","","Derivo, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.491 Fe0.891 H0.75 Li0.028 Mg0.178 O12 Si1.88 Zn0.008 -","- Al4.491 Fe0.891 H0.75 Li0.028 Mg0.178 O12 Si1.88 Zn0.008 -","- Al17.964 Fe3.564 H3 Li0.112 Mg0.712 O48 Si7.52 Zn0.032 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DER/1 Locality: Derivo, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013766","7.8687","","16.62219","","5.6604","","90","","90.122","","90","","740.35","","","","","","","","","","","","Derivo, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.491 Fe0.891 H0.75 Li0.028 Mg0.178 O12 Si1.88 Zn0.008 -","- Al4.491 Fe0.891 H0.75 Li0.028 Mg0.178 O12 Si1.88 Zn0.008 -","- Al17.964 Fe3.564 H3 Li0.112 Mg0.712 O48 Si7.52 Zn0.032 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: DER/10-4 Locality: Derivo, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013767","7.8695","","16.60759","","5.6558","","90","","90.001","","90","","739.176","","","","","","","","","","","","Derivo, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.473 Fe0.847 Li0.028 Mg0.191 O12 Si1.894 Zn0.023 -","- Al4.4725 Fe0.8475 Li0.028 Mg0.1915 O12 Si1.894 Zn0.023 -","- Al17.89 Fe3.39 Li0.112 Mg0.766 O48 Si7.576 Zn0.092 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/FP15 Locality: Derivo, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013768","7.8683","","16.61989","","5.6614","","90","","90.05","","90","","740.343","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.472 Fe0.847 H0.75 Li0.028 Mg0.191 O12 Si1.894 Zn0.023 -","- Al4.4725 Fe0.8475 H0.75 Li0.028 Mg0.1915 O12 Si1.894 Zn0.023 -","- Al17.89 Fe3.39 H3 Li0.112 Mg0.766 O48 Si7.576 Zn0.092 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/1 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013769","7.8666","","16.6198","","5.6581","","90","","90.09","","90","","739.747","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.472 Fe0.847 H0.75 Li0.028 Mg0.191 O12 Si1.894 Zn0.023 -","- Al4.4725 Fe0.8475 H0.75 Li0.028 Mg0.1915 O12 Si1.894 Zn0.023 -","- Al17.89 Fe3.39 H3 Li0.112 Mg0.766 O48 Si7.576 Zn0.092 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/15 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013770","7.8663","","16.62479","","5.6601","","90","","90.1","","90","","740.202","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.472 Fe0.847 H0.75 Li0.028 Mg0.191 O12 Si1.894 Zn0.023 -","- Al4.4725 Fe0.8475 H0.75 Li0.028 Mg0.1915 O12 Si1.894 Zn0.023 -","- Al17.89 Fe3.39 H3 Li0.112 Mg0.766 O48 Si7.576 Zn0.092 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/16 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013771","7.8667","","16.6113","","5.6543","","90","","90.159","","90","","738.879","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.525 Fe0.767 H0.75 Li0.035 Mg0.186 O12 Si1.894 Zn0.025 -","- Al4.5255 Fe0.7675 H0.75 Li0.035 Mg0.1855 O12 Si1.894 Zn0.025 -","- Al18.102 Fe3.07 H3 Li0.14 Mg0.742 O48 Si7.576 Zn0.1 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/5g Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013772","7.8639","","16.6189","","5.6589","","90","","90.169","","90","","739.555","","","","","","","","","","","","Ticino River, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.532 Fe0.822 H0.75 Mg0.165 O12 Si1.894 Zn0.01 -","- Al4.532 Fe0.822 H0.75 Mg0.165 O12 Si1.894 Zn0.01 -","- Al18.128 Fe3.288 H3 Mg0.66 O48 Si7.576 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/2 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013773","7.8689","","16.6202","","5.6594","","90","","90.173","","90","","740.148","","","","","","","","","","","","Ticino River, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.532 Fe0.822 H0.75 Mg0.165 O12 Si1.894 Zn0.01 -","- Al4.532 Fe0.8215 H0.75 Mg0.165 O12 Si1.894 Zn0.01 -","- Al18.128 Fe3.286 H3 Mg0.66 O48 Si7.576 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/6-1 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013774","7.8692","","16.60719","","5.6576","","90","","90.219","","90","","739.36","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.481 Fe0.703 H0.75 Li0.04 Mg0.193 O12 Si1.9 Zn0.135 -","- Al4.4815 Fe0.7035 H0.75 Li0.04 Mg0.1925 O12 Si1.9 Zn0.135 -","- Al17.926 Fe2.814 H3 Li0.16 Mg0.77 O48 Si7.6 Zn0.54 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/8 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013775","7.863","","16.6189","","5.6581","","90","","90.286","","90","","739.36","","","","","","","","","","","","Ticino River, Italy","8","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.453 Fe0.842 H0.75 Li0.053 Mg0.174 O12 Si1.934 Zn0.01 -","- Al4.453 Fe0.842 H0.75 Li0.053 Mg0.174 O12 Si1.934 Zn0.01 -","- Al17.812 Fe3.368 H3 Li0.212 Mg0.696 O48 Si7.736 Zn0.04 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: MAR/21 Locality: Ticino River, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013776","7.8706","","16.5411","","5.6323","","90","","90.007","","90","","733.26","","","","","","","","","","","","Dora Maira, Italy","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.409 Fe0.308 Li0.235 Mg0.603 O12 Si1.99 Zn0.005 -","- Al4.409 Fe0.308 Li0.235 Mg0.603 O12 Si1.99 Zn0.005 -","- Al17.636 Fe1.232 Li0.94 Mg2.412 O48 Si7.96 Zn0.02 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: 85DM66b Locality: Dora Maira, Italy","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9013777","7.8533","","16.5344","","5.6387","","90","","90","","90","","732.183","","","","","","","","","","","","Barrhorn, Switzerland","7","C 1 2/m 1","-C 2y","12","","","Staurolite","- Al4.474 Fe0.088 Li0.128 Mg0.047 O12 Si1.992 Zn0.613 -","- Al4.474 Fe0.088 Li0.128 Mg0.047 O12 Si1.992 Zn0.613 -","- Al17.896 Fe0.352 Li0.512 Mg0.188 O48 Si7.968 Zn2.452 -","4","0.5","","Hawthorne, F. C.; Ungaretti, L.; Oberti, R.; Caucia, F.; Callegari, A.","The crystal chemistry of staurolite. I. Crystal structure and site populations Sample Code: BARR888 Locality: Barrhorn, Switzerland","The Canadian Mineralogist","1993","31","","551","582","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16",""
"9014279","14.3196","","5.7413","","5.0624","","90","","90","","90","","416.196","","","","","","","","","","","","Brazil","5","P b c n","-P 2n 2ab","60","","","Tantalite-(Mn)","- Fe0.09 Mn0.88 Nb0.28 O6 Ta1.72 -","- Fe0.09 Mn0.88 Nb0.28 O6 Ta1.72 -","- Fe0.36 Mn3.52 Nb1.12 O24 Ta6.88 -","4","0.5","","dos Santos, C. A.; Zawislak, L. I.; Kinast, E. J.; Antonietti, V.; da Cunha, J. B. M.","Crystal chemistry and structure of the orthorhombic (Fe,Mn)(Ta,Nb)2O6 family of compounds Note: Sample Mn0.88Fe0.09Ta1.72Nb0.28O6","Brazilian Journal of Physics","2001","31","","616","631","10.1590/S0103-97332001000400012","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9014308","10.875","","10.859","","15.105","","90","","90","","90","","1783.77","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Al6 Ca8.5 Na O18 -","- Al6 Ca8.5 Na O18 -","- Al24 Ca34 Na4 O72 -","4","0.5","","Nishi, F.; Takeuchi, Y.","The Al6O18 rings of tetrahedra in the structure of Ca8.5NaAl6O18","Acta Crystallographica, Section B","1975","31","","1169","1173","10.1107/S0567740875004736","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9014466","5.4952","","5.6486","","7.8561","","90","","90","","90","","243.855","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 1.50 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015054","5.4538","","5.6162","","7.8006","","90","","90","","90","","238.93","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 5.18 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015157","5.4676","","5.6267","","7.8186","","90","","90","","90","","240.536","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 3.94 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015174","14.2737","","5.73543","","5.0554","","90","","90","","90","","413.864","","","","","","","","","","","","Brazil","4","P b c n","-P 2n 2ab","60","","","Columbite-(Fe)","- Fe Nb1.2 O6 Ta0.8 -","- Fe Nb1.2 O6 Ta0.8 -","- Fe4 Nb4.8 O24 Ta3.2 -","4","0.5","","dos Santos, C. A.; Zawislak, L. I.; Kinast, E. J.; Antonietti, V.; da Cunha, J. B. M.","Crystal chemistry and structure of the orthorhombic (Fe,Mn)(Ta,Nb)2O6 family of compounds Note: Sample Fe(Ta0.4Nb0.6)2O6","Brazilian Journal of Physics","2001","31","","616","631","10.1590/S0103-97332001000400012","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015651","5.5142","","5.6634","","7.88162","","90","","90","","90","","246.136","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 0.0 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015771","5.4824","","5.6384","","7.8387","","90","","90","","90","","242.31","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 2.61 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53",""
"9015815","5.43626","","5.60235","","7.77743","","90","","90","","90","","236.868","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 6.73 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53",""
"9015904","18.392","","18.392","","7.646","","90","","90","","120","","2239.87","","","","","","","","","","","","Mont Semiol, Montbrison, Loire, France","8","P 63/m m c","-P 6c 2c","194","","","Mazzite-Mg","- Al4.86 Ca0.53 H31.48 K1.26 Mg Na0.15 O51.74 Si13.14 -","- Al4.86 Ca0.53 H31.48 K1.26 Mg Na0.15 O51.74 Si13.14 -","- Al9.72 Ca1.06 H62.96 K2.52 Mg2 Na0.3 O103.48 Si26.28 -","2","0.0833333","","Galli, E.","Crystal structure refinement of mazzite","Rendiconti della Societa Italiana di Mineralogia e Petrologia","1975","31","","599","612","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9015992","5.5043","","5.6558","","7.8687","","90","","90","","90","","244.962","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 0.738 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016189","5.4448","","5.60887","","7.78906","","90","","90","","90","","237.871","","","","","","","","","","","","Synthetic","3","P b n m","-P 2c 2ab","62","","","Megawite","- Ca O3 Sn -","- Ca O3 Sn -","- Ca4 O12 Sn4 -","4","0.5","","Zhao, J.; Ross, N. L.; Angel, R. J.","Tilting and distortion of CaSnO3 perovskite to 7 GPa determined from single-crystal X-ray diffraction Note: P = 5.98 GPa","Physics and Chemistry of Minerals","2004","31","","299","305","10.1007/s00269-004-0391-1","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9017256","26.188","","7.36","","10.367","","90","","90","","90","","1998.17","","","","","","","","","","","","White Elephant mine, Pringle, South Dakota, USA","6","I m m a","-I 2b 2","74","","","Walentaite","- As2.86 Ca0.708 Fe3 Mn0.652 O19.928 P1.684 -","- As2.86 Ca0.708 Fe3 Mn0.652 O19.928 P1.684 -","- As11.44 Ca2.832 Fe12 Mn2.608 O79.712 P6.736 -","4","0.25","","Grey, I. E.; Mumme, W. G.; Hochleitner, R.","Trimeric As3+3O6 clusters in walentaite: crystal structure and revised formula","European Journal of Mineralogy","2019","31","","111","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017257","6.307","","11.074","","13.085","","90","","99.62","","90","","901.054","","","","100","","","","","","","","Hagendorf-Sud pegmatite, Oberpfalz, Bavaria, Germany","8","P 1 21/m 1","-P 2yb","11","","","Manganflurlite","- Al0.04 Fe2.07 H19 Mg0.06 Mn1.53 O23 P3 Zn1.3 -","- Al0.04 Fe2.07 H19 Mg0.06 Mn1.53 O23 P3 Zn1.3 -","- Al0.08 Fe4.14 H38 Mg0.12 Mn3.06 O46 P6 Zn2.6 -","2","0.5","","Kampf, A. R.; Grey, I. E.; MacRae, C. M.; Keck, E.","Manganflurlite, ZnMn32+Fe3+(PO4)3(OH)2(H2O)7·2H2O, a new schoonerite-related mineral from the Hagendorf-Sud pegmatite Note: T = 100 K","European Journal of Mineralogy","2019","31","","127","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9017258","14.0016","","16.8593","","5.1831","","90","","90","","90","","1223.51","","","","","","","","","","","","Hagendorf Sud pegmatite, Oberpfalz, Bavaria","6","B b m m","-B 2 2b","63","","","Ferrorockbridgeite","- Fe4.44 H5.88 Mn0.52 O17 P3 Zn0.04 -","- Fe4.44 H5.88 Mn0.52 O17 P3 Zn0.04 -","- Fe17.76 H23.52 Mn2.08 O68 P12 Zn0.16 -","4","0.25","","Grey, I. E.; Kampf, A. R.; Keck, E.; Cashion, J. D.; MacRae, C. M.; Gozukara, Y.; Peterson, V. K.; Shanks, F. L.","The rockbridgeite group approved and a new member, ferrorockbridgeite, (Fe2+,Mn2+)2(Fe3+)3(PO4)3(OH)4(H2O), described from the Hagendorf Sud pegmatite, Oberpfalz, Bavaria Note: neutron powder on sample IGC90","European Journal of Mineralogy","2019","31","","389","397","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017259","13.995","","16.884","","5.1866","","90","","90","","90","","1225.55","","","","100","","","","","","","","Hagendorf Sud pegmatite, Oberpfalz, Bavaria","6","B b m m","-B 2 2b","63","","","Ferrorockbridgeite","- Fe4.17 H5.78 Mn0.77 O17 P3 Zn0.06 -","- Fe4.17 H5.78 Mn0.77 O17 P3 Zn0.06 -","- Fe16.68 H23.12 Mn3.08 O68 P12 Zn0.24 -","4","0.25","","Grey, I. E.; Kampf, A. R.; Keck, E.; Cashion, J. D.; MacRae, C. M.; Gozukara, Y.; Peterson, V. K.; Shanks, F. L.","The rockbridgeite group approved and a new member, ferrorockbridgeite, (Fe2+,Mn2+)2(Fe3+)3(PO4)3(OH)4(H2O), described from the Hagendorf Sud pegmatite, Oberpfalz, Bavaria Note: X-ray single crystal on sample IGC29 Note: T = 100 K","European Journal of Mineralogy","2019","31","","389","397","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017260","9.183","","12.349","","5.0081","","90","","100.23","","90","","558.894","","","","","","","","","","","","Spring Creek mine, South Australia, Australia","10","P 1 21/m 1","-P 2yb","11","","","Strontioperloffite","- Al0.02 Ba0.38 Ca0.04 Fe2.08 H3 Mn1.86 Na0.02 O15 P3 Sr0.6 -","- Al0.02 Ba0.38 Ca0.04 Fe2.08 H3 Mn1.86 Na0.02 O15 P3 Sr0.6 -","- Al0.04 Ba0.76 Ca0.08 Fe4.16 H6 Mn3.72 Na0.04 O30 P6 Sr1.2 -","2","0.5","","Elliott, P.","Strontioperloffite, SrMn22+Fe32+PO43+OH3, a new bjarebyite-group mineral from the Spring Creek mine, South Australia, Australia","European Journal of Mineralogy","2019","31","","549","555","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017261","13.909","","5.186","","12.159","","90","","98.88","","90","","866.541","","","","","","","","","","","","Krasno near Horni Slavkov, Czech Republic","5","P 1 2/a 1","-P 2ya","13","","","Kenngottite","- Fe3.85 H8.74 Mn3 O24.08 P4 -","- Fe3.85 H8.74 Mn3 O24.08 P4 -","- Fe7.7 H17.48 Mn6 O48.16 P8 -","2","0.5","","Sejkora, J.; Grey, I. E.; Kampf, A. R.","Kenngottite, Mn32+Fe43+(PO4)4(OH)6(H2O)2: a new phosphate mineral from Krasno near Horni Slavkov, Czech Republic Note: water and hydroxyl groups are not well located","European Journal of Mineralogy","2019","31","","629","636","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""
"9017262","10.021","","24.137","","6.226","","90","","91.54","","90","","1505.38","","","","","","","","","","","","Foote spodumene mine, North Carolina, USA","8","C 1 2/c 1","-C 2yc","15","","","Fanfaniite","- Al1.96 Ca2 Fe0.1 H10 Mg0.06 Mn0.38 O20 P3 -","- Al1.96 Ca2 Fe0.1 H10 Mg0.06 Mn0.38 O20 P3 -","- Al7.84 Ca8 Fe0.4 H40 Mg0.24 Mn1.52 O80 P12 -","4","0.5","","Grey, I. E.; Kampf, A. R.; Smith, J. B.; MacRae, C. M.; Keck, E.","Fanfaniite, Ca4Mn2+Al4(PO4)6(OH,F)4*12H2O, a new mineral with a montgomeryite-type structure","European Journal of Mineralogy","2019","31","","647","652","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9017263","20.067","","13.197","","6.255","","89.35","","91.21","","112.2","","1533.33","","","","100","","","","","","","","Foote mine, Kings Mountain Mining District, North Carolina, USA","7","P -1","-P 1","2","","","Kingsmountite","- Al4 Ca3.091 Fe0.568 Mg0.14 Mn1.178 O40 P6 -","- Al4.002 Ca3.091 Fe0.568 Mg0.14 Mn1.178 O40 P6 -","- Al8.004 Ca6.182 Fe1.136 Mg0.28 Mn2.356 O80 P12 -","2","1","","Grey, I. E.; Kampf, A. R.; Smith, J. B.; Williams, T.; MacRae, C. M.","The calcioferrite group approved and kingsmountite redefined Note: sample K5, T = 100 K","European Journal of Mineralogy","2019","31","","1007","1014","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46",""
"9017297","6.992","","6.999","","6.24","","90","","90","","90","","305.367","","","","","","","","","","","","Berchtesgaden, Germany","3","B m m b","-B 2b 2","63","","","Anhydrite","- Ca O4 S -","- Ca O4 S -","- Ca4 O16 S4 -","4","0.25","","Morikawa, H.; Tomita, T.; Minato, I.; Iwai, S.","Anhydrite: a refinement","Acta Crystallographica, Section B","1975","31","","2164","2165","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""
"9017833","6.909","","7.401","","9.399","","110.72","","106.05","","92.2","","427.008","","","","","","","","","","","","Schneeberg, Sachsen, Germany","6","P -1","-P 1","2","","","Schumacherite","- As0.44 Bi3 H O10 P0.45 V1.1 -","- As0.44 Bi3 H O10 P0.45 V1.1 -","- As0.88 Bi6 H2 O20 P0.9 V2.2 -","2","1","","Walenta, K.; Dunn, P. J.; Hentschel, G.; Mereiter, K.","Schumacherit, ein neues Wismutmineral von Schneeberg in Sachsen Note: structure determined after the paper was published: Schumacherite, Bi3O(OH)((V0.55,As0.22,P0.23)O4)2, using a triclinic reduced cell instead of the non-reduced cell applied in the publication","Tschermaks Mineralogische und Petrographische Mitteilungen","1983","31","","165","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:53",""