Geometry & MOs

Info

ID:	123738
PubChem CID:	50860340
Reduced:	OSN3C26H31 (1)
Stoich.:	ABC3D26E31 (1)
Weight, g/mol:	420.288912
ΔH_f, kcal/mol:	3.46
Dipole, Da:	2.91
IP(EA), eV:	-7.71(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethylanilino)-N-[(Z)-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]acetamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)/C=C/3\C(=O)N=C(S3)NC4=C(C=C(C=C4)C)C)C(CC1(C)C)C

DOS

IR

Vibrations