Geometry & MOs

Info

ID:	396931
PubChem CID:	135029478
Reduced:	N3O4C18H25 (1)
Stoich.:	A3B4C18D25 (1)
Weight, g/mol:	348.108562
ΔH_f, kcal/mol:	-194.8
Dipole, Da:	4.3
IP(EA), eV:	-9.25(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2-oxo-3-[[4-(trifluoromethyl)phenyl]methyl]-1,4-dihydroquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCC[C@@]1(CC2=CC=CC=C2NC1=O)C(=O)N

DOS

IR

Vibrations