Crystallography Open Database

Information card for entry 7233594

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Structure parameters

Chemical name	2-(4-(4-Methoxyphenyl)-3-methyl-1-phenylindeno[1,2-b]pyrazolo[4,3-e]pyridin-5(1H)-ylidene)malononitrile'
Formula	C30 H19 N5 O
Calculated formula	C30 H19 N5 O
Title of publication	Pyrazolo-fused 4-azafluorenones as key reagents for the synthesis of fluorescent dicyanovinylidene-substituted derivatives
Authors of publication	Orrego-Hernández, Jessica; Lizarazo, Carolina; Cobo, Justo; Portilla, Jaime
Journal of publication	RSC Advances
Year of publication	2019
Journal volume	9
Journal issue	47
Pages of publication	27318
a	14.878 ± 0.007 Å
b	12.149 ± 0.006 Å
c	27.262 ± 0.012 Å
α	90°
β	96.052 ± 0.012°
γ	90°
Cell volume	4900 ± 4 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.09
Residual factor for significantly intense reflections	0.0628
Weighted residual factors for significantly intense reflections	0.1251
Weighted residual factors for all reflections included in the refinement	0.1339
Goodness-of-fit parameter for all reflections included in the refinement	1.121
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301866 (current)	2025-08-23	Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure.	7233594.cif
217892	2019-08-31	cif/ Adding structures of 7233594 via cif-deposit CGI script.	7233594.cif