Detail information of CrH12(ClO2)3

Structure

Basic information

Pretty formulaCrH12(ClO2)3
Full formulaCr2H24Cl6O12
TagsHexaaquachromium chloride
Constituent elementsCl; Cr; H; O;
Number of elements4
Number of sites44
Volume505.66373 Å3
Density1.74996 g/cm3
Source Materials Project

Space group

Spacegroup Number167
Hermann MauguinR-3c
Hall-R 3 2"c
Crystal SystemHexagonal

Lattice Parameters

a8.053 Å b8.053 Å c8.053 Å
α97.929° β97.929° γ97.929°

Note: if the model can't be displayed, try Firefox or Chrome.

Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-214.15365 eV -4.86713 eV -1.42788 eV 3.04590 eV 6.00000 eV 0.00000 eV