Geometry & MOs

Info

ID:	18604
PubChem CID:	544046
Reduced:	OC13H22 (1)
Stoich.:	AB13C22 (1)
Weight, g/mol:	194.167065
ΔH_f, kcal/mol:	-46.05
Dipole, Da:	2.87
IP(EA), eV:	-9.99(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trideca-1,12-dien-7-one

Drug info:

PubChemData

Smile

C=CCCCCC(=O)CCCCC=C

DOS

IR

Vibrations