Crystallography Open Database

Information card for entry 7100557

Preview

Coordinates	7100557.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H27 B Cl2 N2
Calculated formula	C19 H27 B Cl2 N2
SMILES	C1(c2ccccc2)=[N](C2CCCCC2)[B](N1C1CCCCC1)(Cl)Cl
Journal of publication	Chemical Communications
Year of publication	2005
a	10.355 ± 0.005 Å
b	11.914 ± 0.005 Å
c	16.592 ± 0.005 Å
α	73.933 ± 0.005°
β	83.657 ± 0.005°
γ	80.431 ± 0.005°
Cell volume	1935.1 ± 1.4 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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