Geometry & MOs

Info

ID:	412689
PubChem CID:	135085603
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	224.17763
ΔH_f, kcal/mol:	-97.6
Dipole, Da:	2.87
IP(EA), eV:	-10.09(1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-9-methyl-6-propan-2-yldec-6-ene-2,8-dione

Drug info:

PubChemData

Smile

CC1C(O1)(C)C2(CCCCC2)O

DOS

IR

Vibrations