Geometry & MOs

Info

ID:	150970
PubChem CID:	53790667
Reduced:	NOC8H17 (1)
Stoich.:	ABC8D17 (1)
Weight, g/mol:	182.079038
ΔH_f, kcal/mol:	-51.99
Dipole, Da:	2.08
IP(EA), eV:	-9.0(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-hexane-1,2,3,4,5,6-hexol

Drug info:

PubChemData

Smile

CCCCN1CC(C1)CO

DOS

IR

Vibrations