Crystallography Open Database

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Searching journal of publication like 'IUCrJ' volume of publication is 11

COD ID: 1570302
CIF file Original IUCr paper	Formula: - C27 H33 F N4 O4 - Comments: Chen, An; Cai, Peishan; Peng, Yayun; Guo, Minshan; Su, Yuan; Cai, Ting The role of alkyl chain length in the melt and solution crystallization of paliperidone aliphatic prodrugs. IUCrJ 11(Pt 1) (2024) 23-33 Space group: P 1 21/c 1 Cell volume: 2504.5 Cell parameters: 23.295; 10.179; 10.6479; 90; 97.284; 90;

COD ID: 1570303
CIF file	Formula: - C31 H41 F N4 O4 - Comments: Chen, An; Cai, Peishan; Peng, Yayun; Guo, Minshan; Su, Yuan; Cai, Ting The role of alkyl chain length in the melt and solution crystallization of paliperidone aliphatic prodrugs. IUCrJ 11(Pt 1) (2024) 23-33 Space group: P 1 21/c 1 Cell volume: 2918 Cell parameters: 26.953; 10.08; 10.753; 90; 92.658; 90;

COD ID: 1570304
CIF file	Formula: - C35 H49 F N4 O4 - Comments: Chen, An; Cai, Peishan; Peng, Yayun; Guo, Minshan; Su, Yuan; Cai, Ting The role of alkyl chain length in the melt and solution crystallization of paliperidone aliphatic prodrugs. IUCrJ 11(Pt 1) (2024) 23-33 Space group: P 1 21/c 1 Cell volume: 3297.6 Cell parameters: 31.029; 9.9381; 10.8384; 90; 99.374; 90;

COD ID: 1570305
CIF file	Formula: - C39 H57 F N4 O4 - Comments: Chen, An; Cai, Peishan; Peng, Yayun; Guo, Minshan; Su, Yuan; Cai, Ting The role of alkyl chain length in the melt and solution crystallization of paliperidone aliphatic prodrugs. IUCrJ 11(Pt 1) (2024) 23-33 Space group: P 1 21/c 1 Cell volume: 3626.1 Cell parameters: 34.188; 9.828; 10.8068; 90; 92.992; 90;

COD ID: 1570433
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 248.55 Cell parameters: 5.5541; 6.6179; 6.964; 90; 103.835; 90;

COD ID: 1570434
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 241.5 Cell parameters: 5.5277; 6.527; 6.8941; 90; 103.869; 90;

COD ID: 1570435
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 237.59 Cell parameters: 5.5073; 6.493; 6.8431; 90; 103.848; 90;

COD ID: 1570436
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 467 Cell parameters: 4.3394; 8.414; 12.821; 90.55; 93.89; 90.83;

COD ID: 1570437
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 454.5 Cell parameters: 4.2888; 8.3045; 12.7912; 90.249; 93.92; 90.14;

COD ID: 1570438
CIF file	Formula: - C2 H6 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 438.3 Cell parameters: 4.25; 8.198; 12.6105; 90.641; 93.97; 90.04;

COD ID: 1570439
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 431.32 Cell parameters: 6.8268; 8.1428; 7.7731; 90; 93.443; 90;

COD ID: 1570440
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 424.12 Cell parameters: 6.7948; 8.0952; 7.7259; 90; 93.621; 90;

COD ID: 1570441
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 418.7 Cell parameters: 6.7759; 8.0552; 7.6873; 90; 93.713; 90;

COD ID: 1570442
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 415.29 Cell parameters: 6.7612; 8.0271; 7.6687; 90; 93.784; 90;

COD ID: 1570443
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: I 1 2/a 1 Cell volume: 416.08 Cell parameters: 7.7073; 4.0885; 13.233; 90; 93.793; 90;

COD ID: 1570444
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 202.56 Cell parameters: 5.1196; 5.6659; 7.2999; 97.275; 102.728; 96.747;

COD ID: 1570445
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 198.13 Cell parameters: 5.0809; 5.6329; 7.2451; 97.382; 102.749; 97.002;

COD ID: 1570446
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 196.6 Cell parameters: 5.072; 5.629; 7.215; 97.43; 102.91; 97.15;

COD ID: 1570447
CIF file	Formula: - C4 H10 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P -1 Cell volume: 190.31 Cell parameters: 5.0182; 5.575; 7.136; 97.36; 102.81; 97.72;

COD ID: 1570448
CIF file	Formula: - C6 H14 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 601.7 Cell parameters: 9.416; 4.1817; 15.579; 90; 101.23; 90;

COD ID: 1570449
CIF file	Formula: - C6 H14 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 585.5 Cell parameters: 9.368; 4.1229; 15.434; 90; 100.84; 90;

COD ID: 1570450
CIF file	Formula: - C6 H14 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 564.8 Cell parameters: 9.293; 4.0686; 15.1855; 90; 100.35; 90;

COD ID: 1570451
CIF file	Formula: - C6 H14 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 543.2 Cell parameters: 9.198; 4.0064; 14.9459; 90; 99.54; 90;

COD ID: 1570452
CIF file	Formula: - C6 H14 O - Comments: Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ 11(Pt 1) (2024) 57-61 Space group: P 1 21/c 1 Cell volume: 520.5 Cell parameters: 9.099; 3.9465; 14.649; 90; 98.32; 90;

COD ID: 1570607
CIF file Original IUCr paper	Formula: - Na0.23 O2.17 Si1.04 - Comments: Hogan-Lamarre, Pascal; Luo, Yi; Bücker, Robert; Miller, R. J. Dwayne; Zou, Xiaodong STEM SerialED: achieving high-resolution data for ab initio structure determination of beam-sensitive nanocrystalline materials. IUCrJ 11(Pt 1) (2024) 62-72 Space group: F d -3 m :2 Cell volume: 15625 Cell parameters: 25; 25; 25; 90; 90; 90;

COD ID: 1570608
CIF file	Formula: - Na21.6 O201.92 Si96 - Comments: Hogan-Lamarre, Pascal; Luo, Yi; Bücker, Robert; Miller, R. J. Dwayne; Zou, Xiaodong STEM SerialED: achieving high-resolution data for ab initio structure determination of beam-sensitive nanocrystalline materials. IUCrJ 11(Pt 1) (2024) 62-72 Space group: F d -3 m :2 Cell volume: 15625 Cell parameters: 25; 25; 25; 90; 90; 90;

COD ID: 1570609
CIF file	Formula: - Na156 O2880 Si1440 - Comments: Hogan-Lamarre, Pascal; Luo, Yi; Bücker, Robert; Miller, R. J. Dwayne; Zou, Xiaodong STEM SerialED: achieving high-resolution data for ab initio structure determination of beam-sensitive nanocrystalline materials. IUCrJ 11(Pt 1) (2024) 62-72 Space group: I -4 3 m Cell volume: 81008 Cell parameters: 43.269; 43.269; 43.269; 90; 90; 90;

COD ID: 1571086
CIF file	Formula: - C15 H11 Br N2 O4 - Comments: Shahbaz, Muhammad; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer Cocrystals of a coumarin derivative: an efficient approach towards anti-leishmanial cocrystals against MIL-resistant Leishmania tropica. IUCrJ 11(2) (2024) 224-236 Space group: P -1 Cell volume: 715.12 Cell parameters: 5.1722; 11.4102; 12.6516; 76.401; 85.975; 80.371;

COD ID: 1571087
CIF file	Formula: - C16 H11 F3 N2 O4 - Comments: Shahbaz, Muhammad; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer Cocrystals of a coumarin derivative: an efficient approach towards anti-leishmanial cocrystals against MIL-resistant Leishmania tropica. IUCrJ 11(2) (2024) 224-236 Space group: C 1 2/c 1 Cell volume: 2991.3 Cell parameters: 28.3874; 4.9666; 21.326; 90; 95.807; 90;

COD ID: 1571088
CIF file	Formula: - C16 H14 N2 O4 - Comments: Shahbaz, Muhammad; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer Cocrystals of a coumarin derivative: an efficient approach towards anti-leishmanial cocrystals against MIL-resistant Leishmania tropica. IUCrJ 11(2) (2024) 224-236 Space group: P 1 21/c 1 Cell volume: 1439.31 Cell parameters: 8.5818; 21.8411; 7.7116; 90; 95.273; 90;

COD ID: 1571089
CIF file	Formula: - C17 H13 N O6 - Comments: Shahbaz, Muhammad; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer Cocrystals of a coumarin derivative: an efficient approach towards anti-leishmanial cocrystals against MIL-resistant Leishmania tropica. IUCrJ 11(2) (2024) 224-236 Space group: P 1 21/n 1 Cell volume: 1455.74 Cell parameters: 11.6158; 7.6829; 16.7602; 90; 103.279; 90;

COD ID: 1571090
CIF file	Formula: - C12 H9 N4 O4 - Comments: Shahbaz, Muhammad; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer Cocrystals of a coumarin derivative: an efficient approach towards anti-leishmanial cocrystals against MIL-resistant Leishmania tropica. IUCrJ 11(2) (2024) 224-236 Space group: P n a 21 Cell volume: 1188.5 Cell parameters: 26.172; 3.9741; 11.4267; 90; 90; 90;

COD ID: 1571127

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1230.64
Cell parameters: 19.5688; 4.0772; 15.9523; 90; 104.783; 90;

COD ID: 1571128

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1209.6
Cell parameters: 19.55; 4.0396; 15.854; 90; 104.96; 90;

COD ID: 1571129

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1192.2
Cell parameters: 19.561; 4.001; 15.776; 90; 105.08; 90;

COD ID: 1571130

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1159.5
Cell parameters: 19.582; 3.9289; 15.625; 90; 105.3; 90;

COD ID: 1571131

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1162.3
Cell parameters: 19.581; 3.9351; 15.64; 90; 105.31; 90;

COD ID: 1571132

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1137.5
Cell parameters: 19.604; 3.8747; 15.531; 90; 105.37; 90;

COD ID: 1571133

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1122.8
Cell parameters: 19.612; 3.8444; 15.462; 90; 105.61; 90;

COD ID: 1571134

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1117.7
Cell parameters: 19.598; 3.8374; 15.442; 90; 105.76; 90;

COD ID: 1571135

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1099.2
Cell parameters: 19.631; 3.7932; 15.352; 90; 105.95; 90;

COD ID: 1571136

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1087.2
Cell parameters: 19.635; 3.7664; 15.296; 90; 106.03; 90;

COD ID: 1571137

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1066.1
Cell parameters: 19.647; 3.7198; 15.191; 90; 106.21; 90;

COD ID: 1571138

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1073.8
Cell parameters: 19.647; 3.7375; 15.222; 90; 106.12; 90;

COD ID: 1571139

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1070.5
Cell parameters: 19.662; 3.7264; 15.211; 90; 106.16; 90;

COD ID: 1571140

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1063.7
Cell parameters: 19.648; 3.7139; 15.171; 90; 106.08; 90;

COD ID: 1571141

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1051.3
Cell parameters: 19.67; 3.6881; 15.112; 90; 106.48; 90;

COD ID: 1571142

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: C 1 2/c 1
Cell volume: 1039.6
Cell parameters: 19.687; 3.6609; 15.043; 90; 106.48; 90;

COD ID: 1571143

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: P 1 21/c 1
Cell volume: 1015.7
Cell parameters: 8.412; 7.9665; 15.576; 90; 103.33; 90;

COD ID: 1571144

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: P 1 21/c 1
Cell volume: 1001.6
Cell parameters: 8.438; 7.9032; 15.425; 90; 103.18; 90;

COD ID: 1571145

CIF file

Original IUCr paper

Formula: - C13 H12 N2 O4 -
Comments: Patyk-Kaźmierczak, Ewa; Izquierdo-Ruiz, Fernando; Lobato, Alvaro; Kaźmierczak, Michał; Moszczyńska, Ida; Olejniczak, Anna; Recio, J. Manuel The curious case of proton migration under pressure in the malonic acid and 4,4'-bipyridine cocrystal. IUCrJ 11(2) (2024) 168-181
Space group: P 1 21/c 1
Cell volume: 989.4
Cell parameters: 8.4; 7.886; 15.389; 90; 103.93; 90;

COD ID: 1571262
CIF file Original IUCr paper	Formula: - C5 H6 N2 O2 - Comments: Olech, Barbara; Brázda, Petr; Palatinus, Lukas; Dominiak, Paulina Maria Dynamical refinement with multipolar electron scattering factors. IUCrJ 11(3) (2024) Space group: I b a m Cell volume: 1083.14 Cell parameters: 13.1931; 13.214; 6.213; 90; 90; 90;

COD ID: 1571263
CIF file Original IUCr paper	Formula: - C5 H6 N2 O2 - Comments: Olech, Barbara; Brázda, Petr; Palatinus, Lukas; Dominiak, Paulina Maria Dynamical refinement with multipolar electron scattering factors. IUCrJ 11(3) (2024) Space group: I b a m Cell volume: 1083.14 Cell parameters: 13.1931; 13.214; 6.213; 90; 90; 90;

COD ID: 1571264
CIF file Original IUCr paper	Formula: - C5 H6 N2 O2 - Comments: Olech, Barbara; Brázda, Petr; Palatinus, Lukas; Dominiak, Paulina Maria Dynamical refinement with multipolar electron scattering factors. IUCrJ 11(3) (2024) Space group: I b a m Cell volume: 1083.14 Cell parameters: 13.1931; 13.214; 6.213; 90; 90; 90;

COD ID: 1571596
CIF file Original IUCr paper	Formula: - C41 H30 N4 O - Comments: Bourda, Laurens; Bhandary, Subhrajyoti; Ito, Sho; Göb, Christian R; Van Der Voort, Pascal; Van Hecke, Kristof Analysis of COF-300 synthesis: probing degradation processes and 3D electron diffraction structure. IUCrJ 11(4) (2024) Space group: I 41/a :2 Cell volume: 3771 Cell parameters: 20.7; 20.7; 8.8; 90; 90; 90;

COD ID: 1571597
CIF file Original IUCr paper	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1353.63 Cell parameters: 7.1511; 10.90793; 17.7744; 90; 102.494; 90;

COD ID: 1571598
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1403.47 Cell parameters: 7.235; 11.2573; 17.7365; 90; 103.701; 90;

COD ID: 1571599
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1403.47 Cell parameters: 7.235; 11.2573; 17.7365; 90; 103.701; 90;

COD ID: 1571600
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1284.44 Cell parameters: 6.9685; 10.7405; 17.5252; 90; 101.697; 90;

COD ID: 1571601
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1284.44 Cell parameters: 6.9685; 10.7405; 17.5252; 90; 101.697; 90;

COD ID: 1571602
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1260.47 Cell parameters: 6.90862; 10.655; 17.4709; 90; 101.448; 90;

COD ID: 1571603
CIF file	Formula: - C20 H14 O2 - Comments: Zwolenik, A.; Tchoń, D; Makal, A. Evolution of structure and spectroscopic properties of a new 1,3-diacetylpyrene polymorph with temperature and pressure. IUCrJ 11(4) (2024) Space group: P 1 21/c 1 Cell volume: 1227.5 Cell parameters: 6.8196; 10.5519; 17.3617; 90; 100.735; 90;

COD ID: 1571772
CIF file Original IUCr paper	Formula: - C29 H21 N O7 - Comments: Sobczak, Szymon; Katrusiak, Andrzej Structural insight into piezo-solvatochromism of Reichardt's dye. IUCrJ 11(4) (2024) Space group: C 2 2 21 Cell volume: 2666 Cell parameters: 15.311; 23.948; 7.27; 90; 90; 90;

COD ID: 1571773
CIF file	Formula: - C33 H37 N O5 - Comments: Sobczak, Szymon; Katrusiak, Andrzej Structural insight into piezo-solvatochromism of Reichardt's dye. IUCrJ 11(4) (2024) Space group: P 1 21/n 1 Cell volume: 2746 Cell parameters: 10.4704; 19.8; 13.3135; 90; 95.819; 90;

COD ID: 1571774
CIF file	Formula: - C33 H37 N O5 - Comments: Sobczak, Szymon; Katrusiak, Andrzej Structural insight into piezo-solvatochromism of Reichardt's dye. IUCrJ 11(4) (2024) Space group: P 1 21/n 1 Cell volume: 2620 Cell parameters: 10.425; 19.26; 13.112; 90; 95.7; 90;

COD ID: 1571775
CIF file	Formula: - C37 H45 N O6 - Comments: Sobczak, Szymon; Katrusiak, Andrzej Structural insight into piezo-solvatochromism of Reichardt's dye. IUCrJ 11(4) (2024) Space group: R 3 c :H Cell volume: 15674 Cell parameters: 24.062; 24.062; 31.259; 90; 90; 120;

COD ID: 1571776
CIF file	Formula: - C37 H45 N O6 - Comments: Sobczak, Szymon; Katrusiak, Andrzej Structural insight into piezo-solvatochromism of Reichardt's dye. IUCrJ 11(4) (2024) Space group: R 3 c :H Cell volume: 14966 Cell parameters: 23.645; 23.645; 30.91; 90; 90; 120;

COD ID: 1571818
CIF file Original IUCr paper	Formula: - C15 H16 O3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: I 1 2/a 1 Cell volume: 4930.4 Cell parameters: 23.913; 7.635; 27.048; 90; 93.244; 90;

COD ID: 1571819
CIF file Original IUCr paper	Formula: - C115.57 H79.8 I18 N36 O1.52 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48312 Cell parameters: 78.549; 14.9682; 41.688; 90; 99.709; 90;

COD ID: 1571820
CIF file Original IUCr paper	Formula: - C46.36 H44.73 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15131.6 Cell parameters: 34.3474; 15.1342; 29.5974; 90; 100.42; 90;

COD ID: 1571821
CIF file Original IUCr paper	Formula: - C127.68 H101.08 I18 N36 O2.2 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48083 Cell parameters: 78.299; 14.9565; 41.6827; 90; 99.929; 90;

COD ID: 1571822
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15338.6 Cell parameters: 34.4506; 15.0594; 30.1018; 90; 100.834; 90;

COD ID: 1571823
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 14797.2 Cell parameters: 34.1537; 15.1026; 29.0899; 90; 99.542; 90;

COD ID: 1571824
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15361.6 Cell parameters: 34.4353; 15.0604; 30.1558; 90; 100.809; 90;

COD ID: 1571825
CIF file Original IUCr paper	Formula: - C117.5 H82.13 I18 N36 O1.9 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48118.2 Cell parameters: 78.3675; 14.9505; 41.6842; 90; 99.853; 90;

COD ID: 1571826
CIF file Original IUCr paper	Formula: - C37.73 H27.46 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15387.3 Cell parameters: 34.4432; 15.0627; 30.2136; 90; 100.996; 90;

COD ID: 1571827
CIF file Original IUCr paper	Formula: - C123.96 H93.85 I18 N36 O2.16 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48066 Cell parameters: 78.371; 14.9291; 41.6991; 90; 99.869; 90;

COD ID: 1571828
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 14811.5 Cell parameters: 34.0757; 15.0947; 29.186; 90; 99.38; 90;

COD ID: 1571829
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15190 Cell parameters: 34.3094; 15.0823; 29.8583; 90; 100.538; 90;

COD ID: 1571830
CIF file Original IUCr paper	Formula: - C38.4 H28.81 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15083.4 Cell parameters: 34.3373; 15.0894; 29.5872; 90; 100.291; 90;

COD ID: 1571831
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 14803 Cell parameters: 33.994; 15.064; 29.295; 90; 99.334; 90;

COD ID: 1571832
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 14987.6 Cell parameters: 34.2193; 15.073; 29.5041; 90; 99.979; 90;

COD ID: 1571833
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15166.7 Cell parameters: 34.3369; 15.0656; 29.814; 90; 100.46; 90;

COD ID: 1571834
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15435.8 Cell parameters: 34.494; 15.0307; 30.3347; 90; 101.054; 90;

COD ID: 1571835
CIF file Original IUCr paper	Formula: - C38.78 H26.97 I6 N12 O0.56 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15798.1 Cell parameters: 34.7075; 14.9722; 31.1023; 90; 102.185; 90;

COD ID: 1571836
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15539 Cell parameters: 34.5442; 15.0184; 30.549; 90; 101.346; 90;

COD ID: 1571837
CIF file Original IUCr paper	Formula: - C122.39 H90.76 I18 N36 O2.14 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48064 Cell parameters: 78.142; 14.9754; 41.6691; 90; 99.702; 90;

COD ID: 1571838
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15438.9 Cell parameters: 34.4567; 15.0045; 30.444; 90; 101.219; 90;

COD ID: 1571839
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15246.8 Cell parameters: 34.3531; 15.0637; 29.9781; 90; 100.634; 90;

COD ID: 1571840
CIF file Original IUCr paper	Formula: - C78.84 H55.3 I12 N24 O1.37 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15865.2 Cell parameters: 31.4246; 14.9857; 34.4395; 90; 101.976; 90;

COD ID: 1571841
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15463 Cell parameters: 34.458; 15.0078; 30.486; 90; 101.242; 90;

COD ID: 1571842
CIF file Original IUCr paper	Formula: - C129.97 H101.68 I18 N36 O3.06 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48229.6 Cell parameters: 78.5587; 14.9697; 41.6779; 90; 100.259; 90;

COD ID: 1571843
CIF file Original IUCr paper	Formula: - C119.57 H84.34 I18 N36 O2.31 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48353.6 Cell parameters: 78.8715; 14.9502; 41.6531; 90; 100.102; 90;

COD ID: 1571844
CIF file Original IUCr paper	Formula: - C118.5 H83.2 I18 N36 O2.1 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48219.5 Cell parameters: 78.606; 14.9668; 41.6349; 90; 100.127; 90;

COD ID: 1571845
CIF file Original IUCr paper	Formula: - C122.16 H87.11 I18 N36 O2.83 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 47332 Cell parameters: 77.257; 15.0021; 41.5124; 90; 100.342; 90;

COD ID: 1571846
CIF file Original IUCr paper	Formula: - C39.88 H28.14 I6 N12 O0.78 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15904 Cell parameters: 34.5084; 14.9904; 31.4216; 90; 101.916; 90;

COD ID: 1571847
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15377.4 Cell parameters: 34.4933; 15.028; 30.223; 90; 101.026; 90;

COD ID: 1571848
CIF file Original IUCr paper	Formula: - C82.77 H61.36 I12 N24 O1.75 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15831.4 Cell parameters: 31.387; 15.0302; 34.2836; 90; 101.803; 90;

COD ID: 1571849
CIF file Original IUCr paper	Formula: - C118.14 H82.81 I18 N36 O2.03 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48374.3 Cell parameters: 78.813; 14.9644; 41.657; 90; 100.061; 90;

COD ID: 1571850
CIF file Original IUCr paper	Formula: - C133.79 H110.09 I18 N36 O2.89 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48167.3 Cell parameters: 78.4975; 14.9701; 41.6228; 90; 100.008; 90;

COD ID: 1571851
CIF file Original IUCr paper	Formula: - C39.49 H27.72 I6 N12 O0.7 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15688.2 Cell parameters: 34.4145; 14.9918; 31.0574; 90; 101.744; 90;

COD ID: 1571852
CIF file Original IUCr paper	Formula: - C116 H81.63 I18 N36 O1.37 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 47679 Cell parameters: 77.629; 15.0298; 41.5537; 90; 100.445; 90;

COD ID: 1571853
CIF file Original IUCr paper	Formula: - C115.54 H80.04 I18 N36 O1.51 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48051 Cell parameters: 78.288; 14.9666; 41.6314; 90; 99.913; 90;

COD ID: 1571854
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15329.8 Cell parameters: 34.4156; 15.0804; 30.0607; 90; 100.709; 90;

COD ID: 1571855
CIF file Original IUCr paper	Formula: - C87.42 H68.09 I12 N24 O2.31 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15936.5 Cell parameters: 31.5433; 15.0035; 34.4229; 90; 101.974; 90;

COD ID: 1571856
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15379.1 Cell parameters: 34.48; 15.0207; 30.258; 90; 101.076; 90;

COD ID: 1571857
CIF file Original IUCr paper	Formula: - C143 H124.58 I18 N36 O3.73 Zn9 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 48435 Cell parameters: 78.834; 14.969; 41.7028; 90; 100.198; 90;

COD ID: 1571858
CIF file Original IUCr paper	Formula: - C82.19 H58.83 I12 N24 O2.04 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15860.2 Cell parameters: 31.4571; 14.9918; 34.361; 90; 101.834; 90;

COD ID: 1571859
CIF file Original IUCr paper	Formula: - C40.06 H28.33 I6 N12 O0.81 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15897 Cell parameters: 34.561; 14.99; 31.38; 90; 102.08; 90;

COD ID: 1571860
CIF file Original IUCr paper	Formula: - C85.04 H63.33 I12 N24 O2.09 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15933.8 Cell parameters: 31.5355; 14.9866; 34.4588; 90; 101.931; 90;

COD ID: 1571861
CIF file Original IUCr paper	Formula: - C84.39 H63.55 I12 N24 O2 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 16028 Cell parameters: 31.6699; 14.978; 34.5752; 90; 102.239; 90;

COD ID: 1571862
CIF file Original IUCr paper	Formula: - C84.04 H62.85 I12 N24 O1.98 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15957.3 Cell parameters: 31.5527; 14.9736; 34.5612; 90; 102.244; 90;

COD ID: 1571863
CIF file Original IUCr paper	Formula: - C84.74 H64.37 I12 N24 O1.95 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15926 Cell parameters: 31.5154; 15.0261; 34.3648; 90; 101.863; 90;

COD ID: 1571864
CIF file Original IUCr paper	Formula: - C40.42 H28.72 I6 N12 O0.88 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15989.9 Cell parameters: 34.581; 14.9867; 31.5551; 90; 102.106; 90;

COD ID: 1571865
CIF file Original IUCr paper	Formula: - C94.73 H79.09 I12 N24 O3.08 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15972.6 Cell parameters: 31.6098; 15.0289; 34.3656; 90; 101.939; 90;

COD ID: 1571866
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15235.8 Cell parameters: 34.412; 15.0303; 29.994; 90; 100.858; 90;

COD ID: 1571867
CIF file Original IUCr paper	Formula: - C88.38 H69.11 I12 N24 O2.48 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15894.1 Cell parameters: 31.5448; 14.9824; 34.3898; 90; 102.066; 90;

COD ID: 1571868
CIF file Original IUCr paper	Formula: - C82.5 H59.2 I12 N24 O2.1 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15987.6 Cell parameters: 31.6622; 15.0003; 34.4418; 90; 102.214; 90;

COD ID: 1571869
CIF file Original IUCr paper	Formula: - C87.95 H67.9 I12 N24 O2.58 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15831 Cell parameters: 31.4491; 15.0235; 34.215; 90; 101.68; 90;

COD ID: 1571870
CIF file Original IUCr paper	Formula: - C90.62 H72.78 I12 N24 O2.67 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15935.1 Cell parameters: 31.5672; 15.0183; 34.3644; 90; 102.009; 90;

COD ID: 1571871
CIF file Original IUCr paper	Formula: - C85.35 H63.69 I12 N24 O2.36 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15859.2 Cell parameters: 31.479; 15.0233; 34.2503; 90; 101.732; 90;

COD ID: 1571872
CIF file Original IUCr paper	Formula: - C90.9 H73.02 I12 N24 O2.74 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15925.9 Cell parameters: 31.549; 15.0248; 34.3298; 90; 101.853; 90;

COD ID: 1571873
CIF file Original IUCr paper	Formula: - C100.99 H91.97 I12 N24 O2.88 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15910 Cell parameters: 31.5077; 14.9991; 34.4289; 90; 102.086; 90;

COD ID: 1571874
CIF file Original IUCr paper	Formula: - C90.17 H71.8 I12 N24 O2.69 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15939.3 Cell parameters: 31.5685; 15.041; 34.3133; 90; 101.955; 90;

COD ID: 1571875
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 15388.2 Cell parameters: 34.3804; 15.0439; 30.32; 90; 101.107; 90;

COD ID: 1571876
CIF file Original IUCr paper	Formula: - C92.12 H75.43 I12 N24 O2.75 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15984.8 Cell parameters: 31.6878; 14.9984; 34.4068; 90; 102.171; 90;

COD ID: 1571877
CIF file Original IUCr paper	Formula: - C88.1 H68.2 I12 N24 O2.57 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15890.2 Cell parameters: 31.5313; 15.0299; 34.2616; 90; 101.863; 90;

COD ID: 1571878
CIF file Original IUCr paper	Formula: - C95.66 H80.05 I12.01 N24 O3.27 Zn6.01 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P 1 2/n 1 Cell volume: 15943.8 Cell parameters: 31.6222; 14.9929; 34.405; 90; 102.192; 90;

COD ID: 1571879
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 16283.5 Cell parameters: 35.2833; 14.9084; 31.7352; 90; 102.721; 90;

COD ID: 1571880
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 16338.5 Cell parameters: 35.3636; 14.9223; 31.7483; 90; 102.783; 90;

COD ID: 1571881
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 16324.1 Cell parameters: 35.3704; 14.9099; 31.7401; 90; 102.78; 90;

COD ID: 1571882
CIF file Original IUCr paper	Formula: - C252.44 H188.95 I24 N48 O7.74 Zn12 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P -1 Cell volume: 16016.3 Cell parameters: 18.8343; 29.6438; 32.8648; 67.924; 74.74; 73.01;

COD ID: 1571883
CIF file Original IUCr paper	Formula: - C36 H24 I6 N12 Zn3 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: C 1 2/c 1 Cell volume: 16086.5 Cell parameters: 35.2498; 14.9012; 31.359; 90; 102.417; 90;

COD ID: 1571884
CIF file Original IUCr paper	Formula: - C95.17 H67.86 I12 N24 O1.65 Zn6 - Comments: Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ 11(4) (2024) Space group: P -1 Cell volume: 8064.7 Cell parameters: 15.0552; 18.943; 30.8258; 99.996; 93.338; 110.091;

COD ID: 1572205
CIF file Original IUCr paper	Formula: - C17 H20 N4 S - Comments: Anyfanti, Goulielmina; Husanu, Elena; Andrusenko, Iryna; Marchetti, Danilo; Gemmi, Mauro The crystal structure of olanzapine form III. IUCrJ 11(5) (2024) Space group: P 1 21/c 1 Cell volume: 1664 Cell parameters: 10.708; 16.476; 10.065; 90; 110.43; 90;

COD ID: 1572227
CIF file Original IUCr paper	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572228
CIF file Original IUCr paper	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572229
CIF file Original IUCr paper	Formula: - H1.999998 O1.000002 - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572230
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572231
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572232
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572233
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572234
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572235
CIF file	Formula: - H2 O - Comments: Chodkiewicz, Michał Leszek; Olech, Barbara; Jha, Kunal Kumar; Dominiak, Paulina Maria; Woźniak, Krzysztof Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data. IUCrJ 11(5) (2024) Space group: P 63/m m c Cell volume: 119.42 Cell parameters: 4.3815; 4.3815; 7.183; 90; 90; 120;

COD ID: 1572366
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3434 Cell parameters: 15.35; 13.56; 16.5; 90; 90; 90;

COD ID: 1572367
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3434 Cell parameters: 15.35; 13.56; 16.5; 90; 90; 90;

COD ID: 1572368
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3434 Cell parameters: 15.35; 13.56; 16.5; 90; 90; 90;

COD ID: 1572369
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3434 Cell parameters: 15.35; 13.56; 16.5; 90; 90; 90;

COD ID: 1572370
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3434 Cell parameters: 15.35; 13.56; 16.5; 90; 90; 90;

COD ID: 1572371
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3329.4 Cell parameters: 15.19; 13.39; 16.369; 90; 90; 90;

COD ID: 1572372
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3329.14 Cell parameters: 15.1898; 13.3897; 16.3685; 90; 90; 90;

COD ID: 1572373
CIF file	Formula: - C15 H21 Fe O6 - Comments: Pacoste, Laura; Ignat'ev, Vladislav Mikhailovich; Dominiak, Paulina Maria; Zou, Xiaodong On the structure refinement of metal complexes against 3D electron diffraction data using multipolar scattering factors. IUCrJ 11(5) (2024) Space group: P b c a Cell volume: 3329.14 Cell parameters: 15.1898; 13.3897; 16.3685; 90; 90; 90;

COD ID: 1572395

CIF file

Original IUCr paper

Formula: - C25 H24 Au O P -
Comments: Jastrzębska, Róża; Poręba, Tomasz; Cova, Federico; Tchoń, Daniel M; Makal, Anna Structure-property relationship of a complex photoluminescent arylacetylide-gold(I) compound. I: a pressure-induced phase transformation caught in the act. IUCrJ 11(5) (2024)
Space group: P -1
Cell volume: 2158.26
Cell parameters: 16.0839; 14.224; 10.1393; 109.816; 98.398; 85.874;

COD ID: 1572396

CIF file

Formula: - C25 H24 Au O P -
Comments: Jastrzębska, Róża; Poręba, Tomasz; Cova, Federico; Tchoń, Daniel M; Makal, Anna Structure-property relationship of a complex photoluminescent arylacetylide-gold(I) compound. I: a pressure-induced phase transformation caught in the act. IUCrJ 11(5) (2024)
Space group: P -1
Cell volume: 1982.2
Cell parameters: 15.906; 13.677; 9.7733; 109.591; 98.2; 86.14;

COD ID: 1572397

CIF file

Formula: - C25 H24 Au O P -
Comments: Jastrzębska, Róża; Poręba, Tomasz; Cova, Federico; Tchoń, Daniel M; Makal, Anna Structure-property relationship of a complex photoluminescent arylacetylide-gold(I) compound. I: a pressure-induced phase transformation caught in the act. IUCrJ 11(5) (2024)
Space group: P 1 21/c 1
Cell volume: 1946
Cell parameters: 16.13; 6.7304; 18.096; 90; 97.93; 90;

COD ID: 1572398

CIF file

Formula: - C25 H24 Au O P -
Comments: Jastrzębska, Róża; Poręba, Tomasz; Cova, Federico; Tchoń, Daniel M; Makal, Anna Structure-property relationship of a complex photoluminescent arylacetylide-gold(I) compound. I: a pressure-induced phase transformation caught in the act. IUCrJ 11(5) (2024)
Space group: P 1 21/c 1
Cell volume: 1896.77
Cell parameters: 16.0966; 6.6284; 17.9473; 90; 97.886; 90;

COD ID: 1572415

CIF file

Original IUCr paper

Formula: - C19 H16 Cl N O4 -
Comments: Leung, Helen W.; Copley, Royston C. B.; Lampronti, Giulio I.; Day, Sarah J.; Saunders, Lucy K.; Johnstone, Duncan N.; Midgley, Paul A. From formulation to structure: 3D electron diffraction for the structure solution of a new indomethacin polymorph from an amorphous solid dispersion. IUCrJ 11(5) (2024)
Space group: C 1 2/c 1
Cell volume: 7449
Cell parameters: 43.7; 5.19; 33.43; 90; 100.73; 90;

COD ID: 1572959

CIF file

Formula: - Mg8 O16 Si4 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 285.472
Cell parameters: 4.72942; 10.1528; 5.94525; 90; 90; 90;

COD ID: 1572960

CIF file

Formula: - Mg8 O16 Si4 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 290.342
Cell parameters: 4.756; 10.2035; 5.983; 90; 90; 90;

COD ID: 1572961

CIF file

Formula: - Mg33 O64 Si16 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 1162.88
Cell parameters: 9.5166; 10.2043; 11.9748; 90; 90; 90;

COD ID: 1572962

CIF file

Formula: - Mg33 O64 Si16 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 1162.91
Cell parameters: 9.5167; 10.2047; 11.9746; 90; 90; 90;

COD ID: 1572963

CIF file

Formula: - Mg32 O65 Si16 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 1162.83
Cell parameters: 9.517; 10.2042; 11.9739; 90; 90; 90;

COD ID: 1572964

CIF file

Formula: - Mg32 O64 Si17 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 1162.87
Cell parameters: 9.5164; 10.2043; 11.975; 90; 90; 90;

COD ID: 1572965

CIF file

Formula: - Mg32 O63 Si16 -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P 1
Cell volume: 1162.85
Cell parameters: 9.5166; 10.2044; 11.9744; 90; 90; 90;

COD ID: 1572966

CIF file

Formula: - Mg2 O4 Si -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P b n m
Cell volume: 290.31
Cell parameters: 4.7542; 10.2048; 5.9839; 90; 90; 90;

COD ID: 1572967

CIF file

Formula: - Mg2 O4 Si -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P b n m
Cell volume: 290.05
Cell parameters: 4.7523; 10.2027; 5.9821; 90; 90; 90;

COD ID: 1572968

CIF file

Formula: - Mg2 O4 Si -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P b n m
Cell volume: 290.386
Cell parameters: 4.753; 10.2084; 5.9848; 90; 90; 90;

COD ID: 1572969

CIF file

Formula: - Mg2 O4 Si -
Comments: Jundullah Hanafi, Muchammad Izzuddin; Bastonero, Lorenzo; Murshed, Mohammad Mangir; Robben, Lars; Dononelli, Wilke; Kirsch, Andrea; Marzari, Nicola; Gesing, Thorsten M. Synthesis, structural and spectroscopic characterization of defect-rich forsterite as a representative phase of Martian regolith. IUCrJ 11(6) (2024)
Space group: P b n m
Cell volume: 290.445
Cell parameters: 4.7515; 10.2127; 5.9854; 90; 90; 90;

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