Detail information of MnH12C2NCl3O2

Structure

Basic information

Pretty formulaMnH12C2NCl3O2
Full formulaMn4H48C8N4Cl12O8
TagsDimethylammonium diaquatrichloromanganate(II)
Constituent elementsC; Cl; H; Mn; N; O;
Number of elements6
Number of sites84
Volume985.92765 Å3
Density1.63991 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.646 Å b10.646 Å c9.249 Å
α90.703° β89.297° γ109.832°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-418.56517 eV -4.98292 eV -0.93593 eV 3.96720 eV 19.99967 eV 0.03050 eV