Geometry & MOs

Info

ID:	52017
PubChem CID:	12014789
Reduced:	NOSC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	205.056135
ΔH_f, kcal/mol:	-9.31
Dipole, Da:	2.34
IP(EA), eV:	-8.65(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-sulfanylquinolin-2-one

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C3=C(C1=O)C(=CCS3)C

DOS

IR

Vibrations