Geometry & MOs

Info

ID:	348228
PubChem CID:	127273293
Reduced:	OSN5C16H17 (1)
Stoich.:	ABC5D16E17 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	40.44
Dipole, Da:	5.71
IP(EA), eV:	-8.67(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-1-(oxolane-3-carbonyl)-3,4-dihydro-2H-quinoline-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CN2C=C(C=CC2=N1)NC(=O)C3CCCN3C4=NC=CS4

DOS

IR

Vibrations