Crystallography Open Database

Information card for entry 4500068

Preview

Coordinates	4500068.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	tetrakis(4-aminophenyl)methane
Chemical name	tetrakis(4-aminophenyl)methane
Formula	C25 H24 N4
Calculated formula	C25 H24 N4
SMILES	c1(ccc(cc1)N)C(c1ccc(cc1)N)(c1ccc(cc1)N)c1ccc(cc1)N
Title of publication	Molecular Tectonics. Hydrogen-Bonded Networks Built from Tetra- and Hexaanilines
Authors of publication	Dominic Laliberté,; Thierry Maris; Eric Demers; Fatima Helzy; Mathieu Arseneault; James D. Wuest
Journal of publication	Cryst. Growth & Design
Year of publication	2005
Journal volume	5
Pages of publication	1451 - 1456
a	16.8018 ± 0.0008 Å
b	16.8018 ± 0.0008 Å
c	7.1674 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2023.36 ± 0.18 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	3
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0475
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.1191
Weighted residual factors for all reflections included in the refinement	0.1245
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179531 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/00.	4500068.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4500068.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4500068.cif
26817	2011-09-26	../uploads/cif-deposit/cod/cif Adding structures of 4500068, 4500069, 4500070, 4500071, 4500072 via cif-deposit CGI script.	4500068.cif