Geometry & MOs

Info

ID:	11910
PubChem CID:	123156
Reduced:	OC7H16 (1)
Stoich.:	AB7C16 (1)
Weight, g/mol:	116.120115
ΔH_f, kcal/mol:	-86.63
Dipole, Da:	2.06
IP(EA), eV:	-10.36(2.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylhexan-2-ol

Drug info:

PubChemData

Smile

CCC(C)CC(C)O

DOS

IR

Vibrations