Geometry & MOs

Info

ID:	343563
PubChem CID:	127266736
Reduced:	SO2F3N3C13H16 (1)
Stoich.:	AB2C3D3E13F16 (1)
Weight, g/mol:	294.113506
ΔH_f, kcal/mol:	-199.19
Dipole, Da:	7.25
IP(EA), eV:	-9.12(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-acetyl-3-chloroanilino)-N-methylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C2=CC=C(C=C2)S(=N)(=O)C(F)(F)F)C(=O)N

DOS

IR

Vibrations