Geometry & MOs

Info

ID:	170780
PubChem CID:	75278433
Reduced:	SF2N3O3H15C18 (1)
Stoich.:	AB2C3D3E15F18 (1)
Weight, g/mol:	330.140199
ΔH_f, kcal/mol:	-124.33
Dipole, Da:	5.82
IP(EA), eV:	-9.6(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfanyl-N-(3,4-dimethyl-2-oxo-4aH-quinolin-7-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1OC2=NC3=C(C=C(C=C3S2)F)F)C(=O)C4C=CC(=O)N=C4

DOS

IR

Vibrations