Geometry & MOs

Info

ID:	31317
PubChem CID:	855567
Reduced:	NSO4C17H19 (1)
Stoich.:	ABC4D17E19 (1)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-132.13
Dipole, Da:	3.05
IP(EA), eV:	-8.6(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethyl-7-methoxyquinolin-2-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CCC1=C(N=C2C=C3C(=CC2=C1)OCO3)SCC(=O)OC(C)C

DOS

IR

Vibrations