Geometry & MOs

Info

ID:	392666
PubChem CID:	135017559
Reduced:	FNSO3C18H18 (1)
Stoich.:	ABCD3E18F18 (1)
Weight, g/mol:	186.104465
ΔH_f, kcal/mol:	-109.77
Dipole, Da:	4.22
IP(EA), eV:	-9.74(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E)-4-methyl-1-phenylhexa-1,4-dien-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2F)C(=C)C(=O)C

DOS

IR

Vibrations