Geometry & MOs

Info

ID:	4512
PubChem CID:	11527
Reduced:	OC8H18 (1)
Stoich.:	AB8C18 (1)
Weight, g/mol:	130.135765
ΔH_f, kcal/mol:	-87.07
Dipole, Da:	1.93
IP(EA), eV:	-10.24(2.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octan-3-ol

Drug info:

PubChemData

Smile

CCCCCC(CC)O

DOS

IR

Vibrations