Geometry & MOs

Info

ID:	52015
PubChem CID:	12014787
Reduced:	NSO2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	243.071785
ΔH_f, kcal/mol:	-47.09
Dipole, Da:	4.77
IP(EA), eV:	-8.73(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-2H-thiopyrano[3,2-c]quinolin-5-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations