Crystallography Open Database

Search results

Result: there are 1146 entries in the selection

Download 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 'IuCrJ'

COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
1571873	CIF Paper	C100.99 H91.97 I12 N24 O2.88 Zn6	P 1 2/n 1	31.5077; 14.9991; 34.4289 90; 102.086; 90	15910	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571874	CIF Paper	C90.17 H71.8 I12 N24 O2.69 Zn6	P 1 2/n 1	31.5685; 15.041; 34.3133 90; 101.955; 90	15939.3	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571875	CIF Paper	C36 H24 I6 N12 Zn3	C 1 2/c 1	34.3804; 15.0439; 30.32 90; 101.107; 90	15388.2	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571876	CIF Paper	C92.12 H75.43 I12 N24 O2.75 Zn6	P 1 2/n 1	31.6878; 14.9984; 34.4068 90; 102.171; 90	15984.8	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571877	CIF Paper	C88.1 H68.2 I12 N24 O2.57 Zn6	P 1 2/n 1	31.5313; 15.0299; 34.2616 90; 101.863; 90	15890.2	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571878	CIF Paper	C95.66 H80.05 I12.01 N24 O3.27 Zn6.01	P 1 2/n 1	31.6222; 14.9929; 34.405 90; 102.192; 90	15943.8	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571879	CIF Paper	C36 H24 I6 N12 Zn3	C 1 2/c 1	35.2833; 14.9084; 31.7352 90; 102.721; 90	16283.5	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571880	CIF Paper	C36 H24 I6 N12 Zn3	C 1 2/c 1	35.3636; 14.9223; 31.7483 90; 102.783; 90	16338.5	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571881	CIF Paper	C36 H24 I6 N12 Zn3	C 1 2/c 1	35.3704; 14.9099; 31.7401 90; 102.78; 90	16324.1	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571882	CIF Paper	C252.44 H188.95 I24 N48 O7.74 Zn12	P -1	18.8343; 29.6438; 32.8648 67.924; 74.74; 73.01	16016.3	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571883	CIF Paper	C36 H24 I6 N12 Zn3	C 1 2/c 1	35.2498; 14.9012; 31.359 90; 102.417; 90	16086.5	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1571884	CIF Paper	C95.17 H67.86 I12 N24 O1.65 Zn6	P -1	15.0552; 18.943; 30.8258 99.996; 93.338; 110.091	8064.7	Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11
1572205	CIF Paper	C17 H20 N4 S	P 1 21/c 1	10.708; 16.476; 10.065 90; 110.43; 90	1664	Anyfanti, Goulielmina; Husanu, Elena; Andrusenko, Iryna; Marchetti, Danilo; Gemmi, Mauro The crystal structure of olanzapine form III. IUCrJ, 2024, 11
1572227	CIF Paper	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572228	CIF Paper	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572229	CIF Paper	H1.999998 O1.000002	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572230	CIF	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572231	CIF	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572232	CIF	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11
1572233	CIF	H2 O	P 63/m m c	4.3815; 4.3815; 7.183 90; 90; 120	119.42	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, 2024, 11

Back to the search form
Your own data is not in the COD? Deposit it, thanks!