Geometry & MOs

Info

ID:	406425
PubChem CID:	135077535
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	248.120115
ΔH_f, kcal/mol:	-46.9
Dipole, Da:	2.64
IP(EA), eV:	-9.55(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,5E)-1,6-diphenylhexa-1,5-dien-3-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)/C=C/CCCC=O

DOS

IR

Vibrations