Geometry & MOs

Info

ID:	366193
PubChem CID:	127319608
Reduced:	NSO3C18H25 (1)
Stoich.:	ABC3D18E25 (1)
Weight, g/mol:	350.130028
ΔH_f, kcal/mol:	-139.73
Dipole, Da:	2.37
IP(EA), eV:	-9.44(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations