Crystallography Open Database
Search results
Result: there are 57 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'CrystEngComm' volume of publication is 4
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7204391 | CIF | C6 H5 Pb0.25 | P -4 21 c | 12.111; 12.111; 6.543 90; 90; 90 | 959.7 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204392 | CIF | C24 H20 Sn | P -4 21 c | 12.068; 12.068; 6.557 90; 90; 90 | 954.94 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204393 | CIF | C24 H20 Ge | P -4 21 c | 11.616; 11.616; 6.902 90; 90; 90 | 931.3 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204394 | CIF | C6 H5 Si0.25 | P -4 21 c | 11.4476; 11.4476; 7.0644 90; 90; 90 | 925.77 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7204395 | CIF | C6.25 H5 | P -4 21 c | 10.905; 10.905; 7.285 90; 90; 90 | 866.33 | Claborn, Kacey; Kahr, Bart; Kaminsky, Werner Calculations of optical properties of the tetraphenyl-X family of isomorphous crystals (X = C, Si, Ge, Sn, Pb) CrystEngComm, 2002, 4, 252-256 |
7216557 | CIF | C17 H27 O3 | P 1 21/c 1 | 6.9524; 13.6858; 16.334 90; 100.148; 90 | 1529.9 | Yue, Weimin; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids formed by helical tubuland diols CrystEngComm, 2002, 4, 591 |
7216558 | CIF | C21 H32 O4 | C 1 2/c 1 | 10.87; 16.939; 10.934 90; 93.99; 90 | 2008.4 | Yue, Weimin; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids formed by helical tubuland diols CrystEngComm, 2002, 4, 591 |
7216559 | CIF | C16 H30 O3 | P 1 21/c 1 | 7.1; 13.567; 16.783 90; 106.83; 90 | 1547.4 | Yue, Weimin; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Co-crystalline hydrogen bonded solids formed by helical tubuland diols CrystEngComm, 2002, 4, 591 |
7216560 | CIF | C22 H12 Br2 Cl2 N2 | P 1 21/c 1 | 12.866; 13.845; 12.361 90; 114.8; 90 | 1998.8 | Alshahateet, Solhe F.; Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Interlocking molecular grid lattices involving weak assembly forces CrystEngComm, 2002, 4, 585 |
7216561 | CIF | C22 H16 N2 | P 1 21/c 1 | 13.308; 10.505; 11.296 90; 100.54; 90 | 1552.5 | Alshahateet, Solhe F.; Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Interlocking molecular grid lattices involving weak assembly forces CrystEngComm, 2002, 4, 585 |
7216562 | CIF | C24 H10 F12 N2 O4 Zn | P 1 21/c 1 | 8.1111; 14.1487; 11.7504 90; 106.91; 90 | 1290.19 | Zaman, Md. Badruz; Udachin, Konstantin A.; Ripmeester, John A. One-dimensional coordination polymers generated from 1,2-bis(x-pyridyl)butadiyne (x�= 3 and 4) and bis(hexafluoroacetylacetonato)M(ii) (M = Cu, Mn, Zn) CrystEngComm, 2002, 4, 613 |
7216563 | CIF | C24 H10 F12 Mn N2 O4 | P 1 21/c 1 | 8.1706; 14.3761; 11.5533 90; 105.813; 90 | 1305.71 | Zaman, Md. Badruz; Udachin, Konstantin A.; Ripmeester, John A. One-dimensional coordination polymers generated from 1,2-bis(x-pyridyl)butadiyne (x�= 3 and 4) and bis(hexafluoroacetylacetonato)M(ii) (M = Cu, Mn, Zn) CrystEngComm, 2002, 4, 613 |
7216564 | CIF | C24 H10 Cu F12 N2 O4 | P 1 21/c 1 | 8.0304; 13.8823; 12.0812 90; 106.194; 90 | 1293.38 | Zaman, Md. Badruz; Udachin, Konstantin A.; Ripmeester, John A. One-dimensional coordination polymers generated from 1,2-bis(x-pyridyl)butadiyne (x�= 3 and 4) and bis(hexafluoroacetylacetonato)M(ii) (M = Cu, Mn, Zn) CrystEngComm, 2002, 4, 613 |
7216565 | CIF | C12 H5 F6 Mn N O2 | P -1 | 6.6626; 9.3393; 10.5602 98.648; 101.102; 92.668 | 635.54 | Zaman, Md. Badruz; Udachin, Konstantin A.; Ripmeester, John A. One-dimensional coordination polymers generated from 1,2-bis(x-pyridyl)butadiyne (x�= 3 and 4) and bis(hexafluoroacetylacetonato)M(ii) (M = Cu, Mn, Zn) CrystEngComm, 2002, 4, 613 |
7216566 | CIF | C80 H52 Br12 N6 | P -1 | 13.164; 13.998; 20.75 79.08; 79.91; 80.14 | 3658.4 | Bishop, Roger; Rahman, A. Noman M. M.; Ashmore, Jason; Craig, Donald C.; Scudder, Marcia L. Preparation of solvent-free clathrand structures by the exclusion of an unwelcome guest CrystEngComm, 2002, 4, 605 |
7216567 | CIF | C22 H12 Br4 N2 | F d d 2 | 27.579; 32.87; 4.447 90; 90; 90 | 4031.3 | Bishop, Roger; Rahman, A. Noman M. M.; Ashmore, Jason; Craig, Donald C.; Scudder, Marcia L. Preparation of solvent-free clathrand structures by the exclusion of an unwelcome guest CrystEngComm, 2002, 4, 605 |
7216568 | CIF | C32 H82 Cl10 Cu5 N32 O13 | C m c m | 6.571; 21.718; 12.65 90; 90; 90 | 1805.3 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded supramolecular synthons in complexes of copper(ii) halides with polymethylene-linked bis(amidino-O-alkylurea) ligands CrystEngComm, 2002, 4, 552 |
7216569 | CIF | C11 H32 Cl2 Cu N8 O6 | P -1 | 6.624; 12.677; 13.059 94.082; 99.368; 91.58 | 1078.4 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded supramolecular synthons in complexes of copper(ii) halides with polymethylene-linked bis(amidino-O-alkylurea) ligands CrystEngComm, 2002, 4, 552 |
7216570 | CIF | C10 H25 Cl2 Cu N8 O3.5 | P 1 21/c 1 | 12.656; 13.541; 21.543 90; 90.071; 90 | 3691.9 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded supramolecular synthons in complexes of copper(ii) halides with polymethylene-linked bis(amidino-O-alkylurea) ligands CrystEngComm, 2002, 4, 552 |
7216571 | CIF | C10 H24.6 Br2 Cu N8 O3.3 | P n n a | 21.904; 12.9712; 6.7694 90; 90; 90 | 1923.3 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded supramolecular synthons in complexes of copper(ii) halides with polymethylene-linked bis(amidino-O-alkylurea) ligands CrystEngComm, 2002, 4, 552 |
7216572 | CIF | C8 H22 Cl2 Cu N8 O4 | P -1 | 8.506; 10.264; 10.715 111.71; 93.51; 103.06 | 835.7 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Hydrogen-bonded supramolecular synthons in complexes of copper(ii) halides with polymethylene-linked bis(amidino-O-alkylurea) ligands CrystEngComm, 2002, 4, 552 |
7216573 | CIF | C18 H46 Cl3 Cr N6 O2 | I -4 2 d | 19.013; 19.013; 14.026 90; 90; 90 | 5070.3 | Kalf, Irmgard; Calmuschi, Beatrice; Englert, Ulli Chiral Cr(iii) and Co(iii) complex cations as building blocks for ordered and disordered salts CrystEngComm, 2002, 4, 548 |
7216574 | CIF | C36 H92 Cl6 Co Cr N12 O4 | I 21 21 21 | 18.924; 19.117; 13.892 90; 90; 90 | 5026 | Kalf, Irmgard; Calmuschi, Beatrice; Englert, Ulli Chiral Cr(iii) and Co(iii) complex cations as building blocks for ordered and disordered salts CrystEngComm, 2002, 4, 548 |
7216575 | CIF | C64 H88 As2 N4 O36 V10 | P -1 | 10.4005; 11.8621; 17.3981 97.621; 90.256; 111.417 | 1977.31 | Sharma, Sanjeev; Ramanan, Arunachalam; Zavalij, Peter Y.; Whittingham, M. Stanley The first example of a novel one-dimensional cyclic tetrameric metavanadate: [PPh4]2V4O11 CrystEngComm, 2002, 4, 601 |
7216576 | CIF | C48 H40 O11 P2 V4 | P 1 21/c 1 | 7.7127; 24.2056; 36.5848 90; 94.75; 90 | 6806.6 | Sharma, Sanjeev; Ramanan, Arunachalam; Zavalij, Peter Y.; Whittingham, M. Stanley The first example of a novel one-dimensional cyclic tetrameric metavanadate: [PPh4]2V4O11 CrystEngComm, 2002, 4, 601 |
7216577 | CIF | C86 H18 | C 1 2/c 1 | 25.2074; 9.8028; 17.4609 90; 94.077; 90 | 4303.7 | Litvinov, A. L.; Konarev, D. V.; Kovalevsky, A. Yu.; Neretin, I. S.; Slovokhotov, Yu. L.; Coppens, P.; Lyubovskaya, R. N. Molecular complexes of fullerene C60 with aromatic hydrocarbons containing flexible phenyl substituents CrystEngComm, 2002, 4, 618 |
7216578 | CIF | C84 H18 | P 1 21/c 1 | 13.255; 18.55; 18.597 90; 108.882; 90 | 4326.6 | Litvinov, A. L.; Konarev, D. V.; Kovalevsky, A. Yu.; Neretin, I. S.; Slovokhotov, Yu. L.; Coppens, P.; Lyubovskaya, R. N. Molecular complexes of fullerene C60 with aromatic hydrocarbons containing flexible phenyl substituents CrystEngComm, 2002, 4, 618 |
7216579 | CIF | C114 H41 Cl | P -1 | 10.089; 12.709; 13.642 91.17; 91.06; 111.42 | 1627.4 | Litvinov, A. L.; Konarev, D. V.; Kovalevsky, A. Yu.; Neretin, I. S.; Slovokhotov, Yu. L.; Coppens, P.; Lyubovskaya, R. N. Molecular complexes of fullerene C60 with aromatic hydrocarbons containing flexible phenyl substituents CrystEngComm, 2002, 4, 618 |
7216580 | CIF | C28 H10 | C 1 2/m 1 | 10.4757; 32.92; 10.3173 90; 118.224; 90 | 3135 | Litvinov, A. L.; Konarev, D. V.; Kovalevsky, A. Yu.; Neretin, I. S.; Slovokhotov, Yu. L.; Coppens, P.; Lyubovskaya, R. N. Molecular complexes of fullerene C60 with aromatic hydrocarbons containing flexible phenyl substituents CrystEngComm, 2002, 4, 618 |
7216581 | CIF | C8 H8 Cu N4 Na O2 Se4 | P 1 21/c 1 | 4.0446; 15.7964; 11.6721 90; 91.563; 90 | 745.45 | Ribas, Xavi; Dias, Jo�o; Morgado, Jorge; Wurst, Klaus; Almeida, Manuel; Veciana, Jaume; Rovira, Concepci� Novel Cu(iii) bis-1,2-diselenolene complex with a highly extended 3D framework through Na+ coordination CrystEngComm, 2002, 4, 564 |
7216582 | CIF | C2 H8 N6 Ni S2 | P 1 21/a 1 | 6.057; 6.941; 9.381 90; 94.5; 90 | 393.18 | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. Structural manipulation through selective substitution of hydrogen bonding groups: the supramolecular structures of bis(thiosemicarbazidato)nickel complexes CrystEngComm, 2002, 4, 539 |
7216583 | CIF | C4 H12 N6 Ni S2 | P 1 21/n 1 | 9.956; 4.6144; 10.907 90; 110.034; 90 | 470.76 | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. Structural manipulation through selective substitution of hydrogen bonding groups: the supramolecular structures of bis(thiosemicarbazidato)nickel complexes CrystEngComm, 2002, 4, 539 |
7216584 | CIF | C6 H16 N6 Ni S2 | P -1 | 5.706; 7.19; 7.746 71.278; 88.176; 82.442 | 298.34 | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. Structural manipulation through selective substitution of hydrogen bonding groups: the supramolecular structures of bis(thiosemicarbazidato)nickel complexes CrystEngComm, 2002, 4, 539 |
7216585 | CIF | C8 H20 N6 Ni S2 | P -1 | 5.6675; 7.6228; 8.0307 91.356; 94.19; 96.79 | 343.41 | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. Structural manipulation through selective substitution of hydrogen bonding groups: the supramolecular structures of bis(thiosemicarbazidato)nickel complexes CrystEngComm, 2002, 4, 539 |
7216586 | CIF | C10 H24 N6 Ni S2 | R -3 :H | 26.901; 26.901; 5.7535 90; 90; 120 | 3605.8 | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. Structural manipulation through selective substitution of hydrogen bonding groups: the supramolecular structures of bis(thiosemicarbazidato)nickel complexes CrystEngComm, 2002, 4, 539 |
7216587 | CIF | C22 H17 Cu N3 O5 | P 1 21/c 1 | 13.8567; 8.1216; 17.0761 90; 102.229; 90 | 1878.11 | Lu, Jack Y.; Schauss, Vaughn Two Cu(ii) complexes synthesized by using a solid-state compound with an extended crystal structure as the copper-ion source CrystEngComm, 2002, 4, 623 |
7216588 | CIF | C54 H42 Cu3 N14 O8 | P -1 | 7.5427; 12.6346; 13.8675 79.491; 83.787; 81.277 | 1279.94 | Lu, Jack Y.; Schauss, Vaughn Two Cu(ii) complexes synthesized by using a solid-state compound with an extended crystal structure as the copper-ion source CrystEngComm, 2002, 4, 623 |
7216589 | CIF | C62 H62 N4 O2 | P -1 | 9.4585; 10.2286; 15.4751 71.744; 87.438; 66.696 | 1300.42 | Scott, Janet L.; Downie, Andrew P.; Asami, Masaya; Tanaka, Koichi Chromogenic guest-responsive host compounds which allow rapid guest screening CrystEngComm, 2002, 4, 580 |
7216590 | CIF | C52 H40 N4 O2 | P -1 | 9.1559; 10.5862; 11.6018 89.27; 84.726; 65.225 | 1016.28 | Scott, Janet L.; Downie, Andrew P.; Asami, Masaya; Tanaka, Koichi Chromogenic guest-responsive host compounds which allow rapid guest screening CrystEngComm, 2002, 4, 580 |
7216591 | CIF | C52 H58 N6 O2 | P 1 21/c 1 | 9.0344; 6.3416; 40.15 90; 94.456; 90 | 2293.34 | Scott, Janet L.; Downie, Andrew P.; Asami, Masaya; Tanaka, Koichi Chromogenic guest-responsive host compounds which allow rapid guest screening CrystEngComm, 2002, 4, 580 |
7216592 | CIF | C49 H48 Cl2 N4 O2 | P -1 | 6.3341; 10.972; 16.0192 104.947; 94.277; 93.557 | 1068.81 | Scott, Janet L.; Downie, Andrew P.; Asami, Masaya; Tanaka, Koichi Chromogenic guest-responsive host compounds which allow rapid guest screening CrystEngComm, 2002, 4, 580 |
7216593 | CIF | C12 H28 B2 Cu F6 N8 O4 | P 1 21/c 1 | 13.842; 21.609; 7.486 90; 93.653; 90 | 2234.6 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Generation and structural characterisation of a difluorodimethoxyborate-mediated hydrogen-bonded supramolecular synthon CrystEngComm, 2002, 4, 638 |
7216594 | CIF | C8 H18 B2 Cu F8 N8 O2 | P 1 21/c 1 | 14.907; 11.442; 10.488 90; 94.78; 90 | 1782.7 | Suksangpanya, Unchulee; Blake, Alexander J.; Hubberstey, Peter; Wilson, Claire Generation and structural characterisation of a difluorodimethoxyborate-mediated hydrogen-bonded supramolecular synthon CrystEngComm, 2002, 4, 638 |
7216595 | CIF | C3 H10 Cu0.5 Mn0.5 O8 | P -1 | 5.316; 7.505; 10.365 107.07; 98.9; 95.48 | 386.18 | Rodr�guez-Mart�n, Yolanda; Sanchiz, Joaqu�n; Ruiz-P�rez, Catalina; Lloret, Francesc; Julve, Miguel Alternating cationic?anionic layers in the [Mii(H2O)6][Cuii(mal)2(H2O)] complexes linked through hydrogen bonds (M = Mn, Co, Ni, Cu and Zn; H2mal = malonic acid) CrystEngComm, 2002, 4, 631 |
7216596 | CIF | C3 H10 Co0.5 Cu0.5 O8 | P -1 | 5.266; 7.495; 10.332 107.14; 98.99; 96.17 | 379.77 | Rodr�guez-Mart�n, Yolanda; Sanchiz, Joaqu�n; Ruiz-P�rez, Catalina; Lloret, Francesc; Julve, Miguel Alternating cationic?anionic layers in the [Mii(H2O)6][Cuii(mal)2(H2O)] complexes linked through hydrogen bonds (M = Mn, Co, Ni, Cu and Zn; H2mal = malonic acid) CrystEngComm, 2002, 4, 631 |
7216597 | CIF | C3 H10 Cu0.5 Ni0.5 O8 | P -1 | 5.242; 7.48; 10.278 107.15; 98.77; 96.34 | 375.4 | Rodr�guez-Mart�n, Yolanda; Sanchiz, Joaqu�n; Ruiz-P�rez, Catalina; Lloret, Francesc; Julve, Miguel Alternating cationic?anionic layers in the [Mii(H2O)6][Cuii(mal)2(H2O)] complexes linked through hydrogen bonds (M = Mn, Co, Ni, Cu and Zn; H2mal = malonic acid) CrystEngComm, 2002, 4, 631 |
7216598 | CIF | C3 H10 Cu O8 | P -1 | 5.241; 7.584; 10.219 106.53; 99.52; 93.85 | 381.22 | Rodr�guez-Mart�n, Yolanda; Sanchiz, Joaqu�n; Ruiz-P�rez, Catalina; Lloret, Francesc; Julve, Miguel Alternating cationic?anionic layers in the [Mii(H2O)6][Cuii(mal)2(H2O)] complexes linked through hydrogen bonds (M = Mn, Co, Ni, Cu and Zn; H2mal = malonic acid) CrystEngComm, 2002, 4, 631 |
7216599 | CIF | C3 H10 Cu0.5 O8 Zn0.5 | P -1 | 5.274; 7.5042; 10.314 106.919; 99.15; 95.81 | 380.83 | Rodr�guez-Mart�n, Yolanda; Sanchiz, Joaqu�n; Ruiz-P�rez, Catalina; Lloret, Francesc; Julve, Miguel Alternating cationic?anionic layers in the [Mii(H2O)6][Cuii(mal)2(H2O)] complexes linked through hydrogen bonds (M = Mn, Co, Ni, Cu and Zn; H2mal = malonic acid) CrystEngComm, 2002, 4, 631 |
7216600 | CIF | C8 H14 O2 S4 Zn | P -1 | 9.6113; 15.4223; 15.8657 101.068; 102.869; 105.546 | 2128 | Lai, Chian Sing; Lim, Yu Xian; Yap, Timothy C.; Tiekink, Edward R. T. Molecular paving with zinc thiolates CrystEngComm, 2002, 4, 596 |
7216601 | CIF | C48 H44 B2 Cu F8 N4 S4 | C 1 2/c 1 | 17.2158; 19.9156; 14.3422 90; 103.988; 90 | 4771.6 | Holmes, Kathryn E.; Kelly, Paul F.; Elsegood, Mark R. J. Structural diversity within the products of the reaction of Ph2SNH with copper(ii) tetrafluoroborate CrystEngComm, 2002, 4, 545-547 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!