Detail information of Hg2H2C2NCl5 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	Hg2H2C2NCl5
Full formula	Hg8H8C8N4Cl20
Tags	Dimethylammonium pentachlorodimercurate
Constituent elements	C; Cl; H; Hg; N;
Number of elements	5
Number of sites	48
Volume	1,372.62894 Å³
Density	2.99287 g/cm³
Source	Materials Project

Space group

Spacegroup Number	14
Hermann Mauguin	P21/c
Hall	-P 2ybc
Crystal System	Monoclinic

Lattice Parameters

a	10.866 Å	b	7.433 Å	c	17.395 Å
α	90.000°	β	102.290°	γ	90.000°

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Style

Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-159.79031 eV	-3.32897 eV	-0.01567 eV	0.53350 eV	0.04945 eV	0.73365 eV