Crystallography Open Database

Information card for entry 4060617

Preview

Coordinates	4060617.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H21 Cl2 N3 Pd
Calculated formula	C20 H21 Cl2 N3 Pd
SMILES	[Pd]1(=C2N(C=CN2C(=[N]1c1ccccc1)c1ccccc1)C(C)(C)C)(Cl)Cl
Journal of publication	Organometallics
Year of publication	2006
a	10.2281 ± 0.0002 Å
b	16.4845 ± 0.0004 Å
c	11.6363 ± 0.0003 Å
α	90°
β	98.8095 ± 0.0008°
γ	90°
Cell volume	1938.79 ± 0.08 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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