Geometry & MOs

Info

ID:	176429
PubChem CID:	76048376
Reduced:	NOC16H17 (2)
Stoich.:	ABC16D17 (2)
Weight, g/mol:	486.162954
ΔH_f, kcal/mol:	10.42
Dipole, Da:	4.79
IP(EA), eV:	-7.82(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-benzyl-7-chloro-1-methyl-3-phenyl-3,4-dihydro-2H-quinolin-4-yl)-3-chloro-N-methylaniline

Drug info:

PubChemData

Smile

CNC1=CC(=C(C=C1)C2C(C(N(C3=C2C=CC(=C3)OC)C)CC4=CC=CC=C4)C5=CC=CC=C5)OC

DOS

IR

Vibrations