Geometry & MOs

Info

ID:	62927
PubChem CID:	26737661
Reduced:	SN2O4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	495.190654
ΔH_f, kcal/mol:	-105.22
Dipole, Da:	2.1
IP(EA), eV:	-8.32(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(3R)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carbonyl]-2-pyridin-2-ylquinoline-4-carbohydrazide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2C[C@@H](CO)O

DOS

IR

Vibrations