Geometry & MOs

Info

ID:	395389
PubChem CID:	135025350
Reduced:	O2H12C13 (1)
Stoich.:	A2B12C13 (1)
Weight, g/mol:	158.13068
ΔH_f, kcal/mol:	-44.95
Dipole, Da:	2.66
IP(EA), eV:	-8.87(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-non-5-ene-1,4-diol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC3CCC=C3C2=O

DOS

IR

Vibrations