Geometry & MOs

Info

ID:	384161
PubChem CID:	134976461
Reduced:	FNSH14C17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	350.13068
ΔH_f, kcal/mol:	42.53
Dipole, Da:	3.06
IP(EA), eV:	-8.9(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetyl-3,4,5-triphenylcyclopenta-2,4-dien-1-one

Drug info:

PubChemData

Smile

CCSC1=C(C2=C(CC2)C(=C1)C3=CC=C(C=C3)F)C#N

DOS

IR

Vibrations