Geometry & MOs

Info

ID:	4508
PubChem CID:	11513
Reduced:	OC7H16 (1)
Stoich.:	AB7C16 (1)
Weight, g/mol:	116.120115
ΔH_f, kcal/mol:	-85.55
Dipole, Da:	2.03
IP(EA), eV:	-10.29(2.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptan-4-ol

Drug info:

PubChemData

Smile

CCCC(CCC)O

DOS

IR

Vibrations