Geometry & MOs

Info

ID:	307964
PubChem CID:	125310984
Reduced:	O4N5H15C16 (1)
Stoich.:	A4B5C15D16 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-55.02
Dipole, Da:	9.67
IP(EA), eV:	-9.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[[(2R)-2,3-dihydrofuran-2-yl]methyl]-2-oxo-5,6,7,8-tetrahydro-3H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)[C@@H]2CC(=O)N=C3N2NC(=N3)COC4=CC=CC=C4

DOS

IR

Vibrations