Geometry & MOs

Info

ID:	4982
PubChem CID:	12374
Reduced:	OC3H7 (2)
Stoich.:	AB3C7 (2)
Weight, g/mol:	118.09938
ΔH_f, kcal/mol:	-112.49
Dipole, Da:	3.04
IP(EA), eV:	-10.34(2.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexane-1,6-diol

Drug info:

PubChemData

Smile

C(CCCO)CCO

DOS

IR

Vibrations