Geometry & MOs

Info

ID:	9496
PubChem CID:	90139
Reduced:	ZrO4C12H28 (1)
Stoich.:	AB4C12D28 (1)
Weight, g/mol:	326.103458
ΔH_f, kcal/mol:	-225.5
Dipole, Da:	6.74
IP(EA), eV:	-6.98(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-1-olate;zirconium(4+)

Drug info:

PubChemData

Smile

CCC[O-].CCC[O-].CCC[O-].CCC[O-].[Zr+4]

DOS

IR

Vibrations