Detail information of MnPH2(CO)4

Structure

Basic information

Pretty formulaMnPH2(CO)4
Full formulaMn6P6H12C24O24
TagsCyclo-tris-mue-phosphido-(tetracarbonylmanganese)
Constituent elementsC; H; Mn; O; P;
Number of elements5
Number of sites72
Volume1,080.49081 Å3
Density1.84391 g/cm3
Source Materials Project

Space group

Spacegroup Number13
Hermann MauguinP2/c
Hall-P 2yc
Crystal SystemMonoclinic

Lattice Parameters

a9.122 Å b9.836 Å c12.742 Å
α90.000° β109.073° γ90.000°

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
-484.51525 eV -6.72938 eV -0.62955 eV 3.15600 eV 0.00000 eV 0.77080 eV