Geometry & MOs

Info

ID:	320507
PubChem CID:	126661485
Reduced:	NC14H19 (1)
Stoich.:	AB14C19 (1)
Weight, g/mol:	400.110919
ΔH_f, kcal/mol:	65.88
Dipole, Da:	1.26
IP(EA), eV:	-8.86(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-butyl-3-[5-cyano-3-(3,5-dichlorophenyl)-2-methylphenyl]-2-methylprop-2-enamide

Drug info:

PubChemData

Smile

C/C=C(\CC#C)/C(=N/C(=C\C)/C(=C)C)C

DOS

IR

Vibrations