Crystallography Open Database

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1571670 CIFC23 H23 N O3 SP 21 21 217.7942; 10.2718; 25.9536
90; 90; 90
2077.86Wu, Yafei; Wang, Zhuo; Shan, Yuqian; Ma, Yukun; Li, Teng; Yuan, Chunhao; Guo, Hongchao; Mao, Biming
Palladium-catalyzed asymmetric [4 + 3] cycloaddition of methylene-trimethylenemethane: access to seven-membered exocyclic axially chiral allenes.
Chemical science, 2024, 15, 9703-9708
1571671 CIFC26 H27 F N2 O8 Zn2I 4/m c m15.4014; 15.4014; 19.1444
90; 90; 90
4541.11Di, Tuo; Yoshida, Yukihiro; Otake, Ken-Ichi; Kitagawa, Susumu; Kitagawa, Hiroshi
Increased CO<sub>2</sub>/N<sub>2</sub> selectivity by stepwise fluorination in isoreticular ultramicroporous metal-organic frameworks.
Chemical science, 2024, 15, 9641-9648
1571672 CIFC26 H26 F2 N2 O8 Zn2P 4/m m m10.9257; 10.9257; 9.5984
90; 90; 90
1145.77Di, Tuo; Yoshida, Yukihiro; Otake, Ken-Ichi; Kitagawa, Susumu; Kitagawa, Hiroshi
Increased CO<sub>2</sub>/N<sub>2</sub> selectivity by stepwise fluorination in isoreticular ultramicroporous metal-organic frameworks.
Chemical science, 2024, 15, 9641-9648
1571680 CIFC118 H138 Cu4 F24 N32 Zr4I 41 2 216.9122; 16.9122; 31.516
90; 90; 90
9014.3Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571681 CIFC29 H24 Cu F12 N8 O0 ZrI 41 2 216.7225; 16.7225; 31.858
90; 90; 90
8908.8Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571682 CIFC27 H25 Cu F12 N8 O0 ZrI 41 2 216.8758; 16.8758; 31.7415
90; 90; 90
9039.7Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571683 CIFC118 H124 Cu4 F24 N32 Zr4I 41 2 217.0131; 17.0131; 31.454
90; 90; 90
9104.2Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571684 CIFC26 H24 Cu F6 N8 ZrI 41 2 217.1374; 17.1374; 31.4
90; 90; 90
9221.9Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571685 CIFC118 H108 Cu4 F24 N32 O16 Zr4I 41 2 217.105; 17.105; 31.249
90; 90; 90
9143Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571686 CIFC26 H18 Cu F12 N8 ZrI 41 2 216.8824; 16.8824; 31.921
90; 90; 90
9098Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571687 CIFC118 H122 Cu4 F24 N32 O16 Zr4I 41 2 216.9799; 16.9799; 31.1337
90; 90; 90
8976.4Li, Yi; Wu, Yanxin; Zhao, Jiaxin; Duan, Jingui; Jin, Wanqin
Systemic regulation of binding sites in porous coordination polymers for ethylene purification from ternary C2 hydrocarbons.
Chemical science, 2024, 15, 9318-9324
1571688 CIFC19 H15 Cl OP 21 21 215.4676; 10.7252; 26.292
90; 90; 90
1541.8Wang, Xunhua; Lv, Ruifeng; Li, Xiaoxun
Kinetic resolution of 1-(1-alkynyl)cyclopropyl ketones <i>via</i> gold-catalyzed divergent (4 + 4) cycloadditions: stereoselective access to furan fused eight-membered heterocycles.
Chemical science, 2024, 15, 9361-9368
1571689 CIFC26 H20 F N O2P 21 21 217.228; 10.686; 25.745
90; 90; 90
1988.5Wang, Xunhua; Lv, Ruifeng; Li, Xiaoxun
Kinetic resolution of 1-(1-alkynyl)cyclopropyl ketones <i>via</i> gold-catalyzed divergent (4 + 4) cycloadditions: stereoselective access to furan fused eight-membered heterocycles.
Chemical science, 2024, 15, 9361-9368
1571690 CIFC40 H32 O6P -112.1952; 12.2266; 12.7568
78.461; 62.446; 64.147
1517.58Wang, Xunhua; Lv, Ruifeng; Li, Xiaoxun
Kinetic resolution of 1-(1-alkynyl)cyclopropyl ketones <i>via</i> gold-catalyzed divergent (4 + 4) cycloadditions: stereoselective access to furan fused eight-membered heterocycles.
Chemical science, 2024, 15, 9361-9368
1571691 CIFC18 H21 N OP b c a9.75307; 16.23315; 18.76027
90; 90; 90
2970.18Sui, Xianwei; Dang, Hang T.; Porey, Arka; Trevino, Ramon; Das, Arko; Fremin, Seth O.; Hughes, William B.; Thompson, William T.; Dhakal, Shree Krishna; Arman, Hadi D.; Larionov, Oleg V.
Acridine photocatalysis enables tricomponent direct decarboxylative amine construction.
Chemical science, 2024, 15, 9582-9590
1571692 CIFC20 H25 NP 1 21/n 15.64642; 20.42415; 13.59672
90; 92.2646; 90
1566.79Sui, Xianwei; Dang, Hang T.; Porey, Arka; Trevino, Ramon; Das, Arko; Fremin, Seth O.; Hughes, William B.; Thompson, William T.; Dhakal, Shree Krishna; Arman, Hadi D.; Larionov, Oleg V.
Acridine photocatalysis enables tricomponent direct decarboxylative amine construction.
Chemical science, 2024, 15, 9582-9590
1571693 CIFC25 H34 N2 O2P -19.2584; 9.9261; 11.8278
93.448; 90.414; 96.639
1077.62Sui, Xianwei; Dang, Hang T.; Porey, Arka; Trevino, Ramon; Das, Arko; Fremin, Seth O.; Hughes, William B.; Thompson, William T.; Dhakal, Shree Krishna; Arman, Hadi D.; Larionov, Oleg V.
Acridine photocatalysis enables tricomponent direct decarboxylative amine construction.
Chemical science, 2024, 15, 9582-9590
1571694 CIFC21 H23 N OP 1 21/n 15.71447; 17.9506; 16.3618
90; 99.38; 90
1655.92Sui, Xianwei; Dang, Hang T.; Porey, Arka; Trevino, Ramon; Das, Arko; Fremin, Seth O.; Hughes, William B.; Thompson, William T.; Dhakal, Shree Krishna; Arman, Hadi D.; Larionov, Oleg V.
Acridine photocatalysis enables tricomponent direct decarboxylative amine construction.
Chemical science, 2024, 15, 9582-9590
1571695 CIFC23 H29 N O3P -18.8935; 14.9861; 16.6162
112.739; 90.306; 103.676
1972.96Sui, Xianwei; Dang, Hang T.; Porey, Arka; Trevino, Ramon; Das, Arko; Fremin, Seth O.; Hughes, William B.; Thompson, William T.; Dhakal, Shree Krishna; Arman, Hadi D.; Larionov, Oleg V.
Acridine photocatalysis enables tricomponent direct decarboxylative amine construction.
Chemical science, 2024, 15, 9582-9590
1571696 CIFC18 H17 N O2P 1 21 15.9523; 13.5277; 9.0395
90; 104.324; 90
705.24Kilgallon, Landon J.; McFadden, Timothy P.; Sigman, Matthew S.; Johnson, Jeremiah A.
Tricyclononenes and tricyclononadienes as efficient monomers for controlled ROMP: understanding structure-propagation rate relationships and enabling facile post-polymerization modification.
Chemical science, 2024, 15, 8334-8345
1571697 CIFC18 H17 N O2P 1 21/m 17.5018; 10.4685; 9.002
90; 108.336; 90
671.06Kilgallon, Landon J.; McFadden, Timothy P.; Sigman, Matthew S.; Johnson, Jeremiah A.
Tricyclononenes and tricyclononadienes as efficient monomers for controlled ROMP: understanding structure-propagation rate relationships and enabling facile post-polymerization modification.
Chemical science, 2024, 15, 8334-8345
1571698 CIFC11 H10 O5P 1 21/c 17.9853; 11.7489; 10.3831
90; 103.886; 90
945.7Kilgallon, Landon J.; McFadden, Timothy P.; Sigman, Matthew S.; Johnson, Jeremiah A.
Tricyclononenes and tricyclononadienes as efficient monomers for controlled ROMP: understanding structure-propagation rate relationships and enabling facile post-polymerization modification.
Chemical science, 2024, 15, 8334-8345
1571699 CIFC16 H25 Cl6 In N2 O4P -17.3505; 9.0364; 18.556
89.703; 88.498; 82.907
1222.67Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571700 CIFC8 H10 Cl N OP 1 21/c 14.8984; 15.8013; 10.8025
90; 102.614; 90
815.94Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571701 CIFC8 H10 Br N OP 1 21/c 14.9287; 16.2486; 10.9152
90; 102.485; 90
853.47Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571702 CIFC16 H22 Br4 N2 O3 ZnP 1 21/c 17.5012; 17.0754; 17.8494
90; 101.815; 90
2237.82Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571703 CIFC16 H20 Cl6 N2 O2 SnP 1 21/c 19.3919; 11.4149; 11.0818
90; 108.353; 90
1127.62Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571704 CIFC16 H22 Cl4 N2 O3 ZnP 1 21/n 17.308; 16.775; 17.665
90; 101.133; 90
2124.8Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Chemical Science, 2024, 15, 10046-10055
1571707 CIFC66.5 H58 D12 SP -19.2015; 15.281; 20.007
104.66; 97.26; 102.4
2609Prajapati, Bibek; Kwenda, Tendai; Lis, Tadeusz; Chmielewski, Piotr J.; Gómez-García, Carlos J.; Majewski, Marcin A.; Stępień, Marcin
Difluorenoheteroles: topological control of π conjugation in diradicaloids and mixed-valence radical ions
Chemical Science, 2024, 15, 10101-10109
1571708 CIFC60 H67 NP -19.141; 16.305; 16.996
105.22; 91.86; 99.67
2401.8Prajapati, Bibek; Kwenda, Tendai; Lis, Tadeusz; Chmielewski, Piotr J.; Gómez-García, Carlos J.; Majewski, Marcin A.; Stępień, Marcin
Difluorenoheteroles: topological control of π conjugation in diradicaloids and mixed-valence radical ions
Chemical Science, 2024, 15, 10101-10109
1571709 CIFC60 H67 NP 1 21/n 19.742; 15.56; 30.552
90; 93.27; 90
4624Prajapati, Bibek; Kwenda, Tendai; Lis, Tadeusz; Chmielewski, Piotr J.; Gómez-García, Carlos J.; Majewski, Marcin A.; Stępień, Marcin
Difluorenoheteroles: topological control of π conjugation in diradicaloids and mixed-valence radical ions
Chemical Science, 2024, 15, 10101-10109
1571710 CIFC160 H170 N14 Ni3P 1 21/n 120.2235; 30.1037; 27.7552
90; 108.649; 90
16010.2Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571711 CIFC160 H170 N14 Ni3P -111.99689; 15.9669; 23.9854
73.518; 89.4513; 80.3482
4339.81Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571712 CIFC160 H168 N14 Ni3P 1 2/n 116.4956; 19.5137; 27.9638
90; 98.4471; 90
8903.6Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571713 CIFC128 H122 Cl5 F6 N10 Ni2 SbP -116.6924; 19.0219; 21.9272
80.695; 71.43; 72.72
6284.6Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571714 CIFC160 H170 N14 Ni3P -112.1732; 15.6437; 24.1466
72.6545; 80.455; 79.266
4282.49Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571715 CIFC205 H229 N14 Ni3 OP 1 21/c 133.012; 17.7275; 30.1749
90; 91.719; 90
17651Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571716 CIFC160 H164 N14 Ni3P -119.5178; 27.725; 28.7677
104.436; 95.669; 104.971
14340.6Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571717 CIFC480 H487 Cl3 N42 Ni9P -119.8298; 27.6668; 28.8267
104.249; 96.2653; 105.308
14526Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin
Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes
Chemical Science, 2024, 15, 10207-10213
1571718 CIFC96 H84 B2 N6P 1 21/c 114.7232; 9.8889; 51.6585
90; 94.723; 90
7495.74Chen, Yi-Kuan; Lei, Jian; Wu, Tien-Lin
Elevating the upconversion performance of a multiple resonance thermally activated delayed fluorescence emitter via an embedded azepine approach
Chemical Science, 2024, 15, 10146-10154
1571719 CIFC48 H36 B N3P b c a20.7278; 13.75053; 25.09061
90; 90; 90
7151.28Chen, Yi-Kuan; Lei, Jian; Wu, Tien-Lin
Elevating the upconversion performance of a multiple resonance thermally activated delayed fluorescence emitter via an embedded azepine approach
Chemical Science, 2024, 15, 10146-10154
1571720 CIFC10 H22 Mg N4 O14I 1 2/a 124.6517; 6.4107; 26.2782
90; 106.673; 90
3978.3Li, Yang; Ok, Kang Min
Crystal clear: unveiling giant birefringence in organic–inorganic cocrystals
Chemical Science, 2024, 15, 10193-10199
1571721 CIFC10 H14 Li2 N4 O10P 1 21/n 18.821; 10.477; 9.205
90; 110.89; 90
794.8Li, Yang; Ok, Kang Min
Crystal clear: unveiling giant birefringence in organic–inorganic cocrystals
Chemical Science, 2024, 15, 10193-10199
1571722 CIFC20 H24 Li2 N6 O12P -18.212; 8.9624; 9.932
82.101; 68.227; 70.184
638.59Li, Yang; Ok, Kang Min
Crystal clear: unveiling giant birefringence in organic–inorganic cocrystals
Chemical Science, 2024, 15, 10193-10199
1571730 CIFC40 H60 Os4 ThP 1 21/c 123.163; 12.6413; 15.781
90; 91.796; 90
4618.6Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
Chemical science, 2024, 15, 9784-9792
1571731 CIFC46 H73 Os4 ThP m n 2118.6052; 9.9998; 13.383
90; 90; 90
2489.88Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
Chemical science, 2024, 15, 9784-9792
1571732 CIFC46 H64 Os4 ThP 42/n c m :213.7391; 13.7391; 25.158
90; 90; 90
4748.9Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
Chemical science, 2024, 15, 9784-9792
1571733 CIFC40 H59 Os4 UC 1 2/c 140.875; 10.0269; 23.315
90; 113.731; 90
8747.7Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
Chemical science, 2024, 15, 9784-9792
1571734 CIFC40 H60 Os4 UP a -321.395; 21.395; 21.395
90; 90; 90
9793.5Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
Chemical science, 2024, 15, 9784-9792
1571735 CIFC30 H36 Br2 N2 O4P -15.1363; 7.0488; 20.63
87.499; 87.373; 75.469
721.85Giri, Indrajit; Chhetri, Shant; John P, Jesslyn; Mondal, Madalasa; Dey, Arka Bikash; Vijayaraghavan, Ratheesh K.
Engineered solid-state aggregates in brickwork stacks of n-type organic semiconductors: a way to achieve high electron mobility.
Chemical science, 2024, 15, 9630-9640

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