Geometry & MOs

Info

ID:	408569
PubChem CID:	135081336
Reduced:	ZrC32H52 (1)
Stoich.:	AB32C52 (1)
Weight, g/mol:	502.022782
ΔH_f, kcal/mol:	36.24
Dipole, Da:	4.73
IP(EA), eV:	-6.66(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH3-].[CH3-].CC1CCC(C(C1)[C]2[CH][CH][CH][CH]2)C(C)C.CC1CCC(C(C1)[C]2[CH][CH][CH][CH]2)C(C)C.[Zr+2]

DOS

IR

Vibrations