Geometry & MOs

Info

ID:	340275
PubChem CID:	127262286
Reduced:	NO4C21H43 (1)
Stoich.:	AB4C21D43 (1)
Weight, g/mol:	334.076057
ΔH_f, kcal/mol:	-248.75
Dipole, Da:	9.87
IP(EA), eV:	-9.33(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chloro-4-hydroxyphenyl)-1,2-diphenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)[O-].C[N+](C)(C)CC(=O)O

DOS

IR

Vibrations