Geometry & MOs

Info

ID:	229774
PubChem CID:	87568929
Reduced:	O4C25H48 (1)
Stoich.:	A4B25C48 (1)
Weight, g/mol:	125.017122
ΔH_f, kcal/mol:	-283.59
Dipole, Da:	8.67
IP(EA), eV:	-10.57(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-1-ol;vanadium

Drug info:

PubChemData

Smile

CCCCCCC(CCCC)CC(C)(CCCCCCCCCC(=O)O)C(=O)O

DOS

IR

Vibrations