Detail information of Mo6H20Cl14O9

Structure

Basic information

Pretty formulaMo6H20Cl14O9
Full formulaMo12H40Cl28O18
TagsBis(oxonium) octa-mue-chloro-octahedro-hexakis(chloro- molybdate) heptahydrate
Constituent elementsCl; H; Mo; O;
Number of elements4
Number of sites98
Volume1,670.99953 Å3
Density2.45679 g/cm3
Source Materials Project

Space group

Spacegroup Number15
Hermann MauguinC2/c
Hall-C 2yc
Crystal SystemMonoclinic

Lattice Parameters

a9.982 Å b9.982 Å c19.863 Å
α83.551° β96.449° γ121.638°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-440.95790 eV -4.49957 eV -1.14374 eV 1.04890 eV 28.00000 eV 0.19159 eV