Geometry & MOs

Info

ID:	12490
PubChem CID:	138602
Reduced:	OC9H14 (1)
Stoich.:	AB9C14 (1)
Weight, g/mol:	138.104465
ΔH_f, kcal/mol:	-42.95
Dipole, Da:	2.8
IP(EA), eV:	-9.48(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethylhepta-1,5-dien-4-one

Drug info:

PubChemData

Smile

CC(=CC(=O)CC(=C)C)C

DOS

IR

Vibrations