Geometry & MOs

Info

ID:	216564
PubChem CID:	85086429
Reduced:	ClNOSC14H16 (1)
Stoich.:	ABCDE14F16 (1)
Weight, g/mol:	280.082347
ΔH_f, kcal/mol:	-34.95
Dipole, Da:	2.89
IP(EA), eV:	-8.82(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-5-(trifluoromethyl)-2,8-dihydropyrrolo[3,2-g]quinolin-7-one

Drug info:

PubChemData

Smile

C1CC2C(C(C(=O)N2C1)SC3=CC=CC=C3)CCl

DOS

IR

Vibrations