Geometry & MOs

Info

ID:	380054
PubChem CID:	134964811
Reduced:	O3C13H18 (1)
Stoich.:	A3B13C18 (1)
Weight, g/mol:	184.14633
ΔH_f, kcal/mol:	-128.3
Dipole, Da:	2.96
IP(EA), eV:	-9.83(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol

Drug info:

PubChemData

Smile

CCCC[C@@H](C1=CC=CC=C1C(=O)OC)O

DOS

IR

Vibrations