Geometry & MOs

Info

ID:	406986
PubChem CID:	135079078
Reduced:	N5O6C22H31 (1)
Stoich.:	A5B6C22D31 (1)
Weight, g/mol:	333.092042
ΔH_f, kcal/mol:	-200.03
Dipole, Da:	5.7
IP(EA), eV:	-9.41(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chloroanilino)-1,3-diphenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C(/C(=N/NC(=O)N)/C)N(CC1=CC=CC=C1)/C(=C/C(=O)OC)/C(=O)OC

DOS

IR

Vibrations