Geometry & MOs

Info

ID:	242746
PubChem CID:	99206011
Reduced:	ClFO2N3C19H21 (1)
Stoich.:	ABC2D3E19F21 (1)
Weight, g/mol:	418.164105
ΔH_f, kcal/mol:	-100.97
Dipole, Da:	3.77
IP(EA), eV:	-9.0(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-2-oxo-5-[(2-phenylmethoxypyridine-4-carbonyl)amino]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3Cl)F

DOS

IR

Vibrations