Geometry & MOs

Info

ID:	175317
PubChem CID:	75882781
Reduced:	NSO2C11H15 (2)
Stoich.:	ABC2D11E15 (2)
Weight, g/mol:	447.162806
ΔH_f, kcal/mol:	-143.3
Dipole, Da:	6.07
IP(EA), eV:	-8.48(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethylphenyl)-N-[2-[(4-fluorophenyl)methylsulfamoyl]ethyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCOC2=C(C=CC=C2C)C

DOS

IR

Vibrations