Detail information of MnH30C8(N13O9)2

Structure

Basic information

Pretty formulaMnH30C8(N13O9)2
Full formulaMn2H60C16N52O36
TagsTribiguanidomanganese(IV) biguuanidium hexanitrate
Constituent elementsC; H; Mn; N; O;
Number of elements5
Number of sites166
Volume1,606.99671 Å3
Density1.72239 g/cm3
Source Materials Project

Space group

Spacegroup Number2
Hermann MauguinP-1
Hall-P 1
Crystal SystemTriclinic

Lattice Parameters

a9.572 Å b13.079 Å c14.657 Å
α106.360° β104.050° γ104.288°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-1,033.31917 eV -6.22481 eV -0.66533 eV 0.84790 eV -1.99998 eV 0.26577 eV