Structure

Basic information

Pretty formulaCoH19S3N5O11
Full formulaCo4H76S12N20O44
TagsBis(pentaammineaquacobalt(III)) tris(dithionate) dihydrate
Constituent elementsCo; H; N; O; S;
Number of elements5
Number of sites156
Volume1,453.73778 Å3
Density1.92039 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a13.561 Å b16.018 Å c6.726 Å
α90.000° β95.749° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-833.04085 eV -5.34001 eV -1.09635 eV 1.38090 eV 7.99998 eV 0.10085 eV