Detail information of CuH12N2(Cl2O)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	CuH12N2(Cl2O)2
Full formula	Cu2H24N4Cl8O4
Tags	Diammonium tetrachlorocuprate dihydrate
Constituent elements	Cl; Cu; H; N; O;
Number of elements	5
Number of sites	42
Volume	464.46812 Å³
Density	1.98396 g/cm³
Source	Materials Project

Space group

Spacegroup Number	136
Hermann Mauguin	P42/mnm
Hall	-P 4n 2n
Crystal System	Tetragonal

Lattice Parameters

a	7.639 Å	b	7.639 Å	c	7.959 Å
α	90.000°	β	90.000°	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
-186.74142 eV	-4.44622 eV	-1.00039 eV	0.53290 eV	1.99315 eV	0.01798 eV