Geometry & MOs

Info

ID:	74007
PubChem CID:	48421342
Reduced:	OSN5C18H23 (1)
Stoich.:	ABC5D18E23 (1)
Weight, g/mol:	303.194677
ΔH_f, kcal/mol:	10.04
Dipole, Da:	5.27
IP(EA), eV:	-8.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCC2C1N(CCC2)C(=O)NC3=NN=C(S3)C4=CC=CC=N4

DOS

IR

Vibrations