Geometry & MOs

Info

ID:	73883
PubChem CID:	48420912
Reduced:	FON2C17H23 (1)
Stoich.:	ABC2D17E23 (1)
Weight, g/mol:	297.184112
ΔH_f, kcal/mol:	-97.12
Dipole, Da:	1.97
IP(EA), eV:	-8.87(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyanophenyl)-8-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC2C1N(CCC2)C(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations