Geometry & MOs

Info

ID:	4953
PubChem CID:	12331
Reduced:	OC7H16 (1)
Stoich.:	AB7C16 (1)
Weight, g/mol:	116.120115
ΔH_f, kcal/mol:	-80.46
Dipole, Da:	2.04
IP(EA), eV:	-10.36(2.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methylhexan-1-ol

Drug info:

PubChemData

Smile

CC(C)CCCCO

DOS

IR

Vibrations