Geometry & MOs

Info

ID:	123722
PubChem CID:	50859673
Reduced:	ON4C24H26 (1)
Stoich.:	AB4C24D26 (1)
Weight, g/mol:	403.225977
ΔH_f, kcal/mol:	52.35
Dipole, Da:	5.53
IP(EA), eV:	-8.08(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-cyano-3-(7-methoxy-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)-N-(2-methylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)OC)/C=C(\C#N)/C3=NC4=CC=CC=C4N3)C)(C)C

DOS

IR

Vibrations