Crystallography Open Database

Information card for entry 4103905

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Structure parameters

Formula	C38 H25 Cl3 N2 O
Calculated formula	C38 H25 Cl3 N2 O
SMILES	ClC(Cl)Cl.O=C(c1ccc(n2c3ccccc3c3ccccc23)cc1)c1ccc(n2c3ccccc3c3ccccc23)cc1
Title of publication	Dendritic Structure Having a Potential Gradient: New Synthesis and Properties of Carbazole Dendrimers
Authors of publication	Ken Albrecht; Kimihisa Yamamoto
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	2244 - 2251
a	8.7902 ± 0.0001 Å
b	45.7088 ± 0.0006 Å
c	7.6051 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	3055.65 ± 0.07 Å³
Cell temperature	223.1 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for significantly intense reflections	0.037
Weighted residual factors for all reflections included in the refinement	0.0346
Goodness-of-fit parameter for all reflections included in the refinement	0.918
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301832 (current)	2025-08-20	Add cross-references to PubChem compounds in COD range 4/10/ Each referenced PubChem compound corresponds to the full crystal structure.	4103905.cif
201982	2017-10-13	cif/ Marking COD entries in range 4 that are known to be related to ChemSpider entries using the _cod_related_entry data loop.	4103905.cif
176467	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4103905.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4103905.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4103905.cif
28382	2011-10-26	../uploads/cif-deposit/cod/cif Adding structures of 4103905 via cif-deposit CGI script.	4103905.cif