Geometry & MOs

Info

ID:	171557
PubChem CID:	75394107
Reduced:	ClFSN2O2C14H14 (1)
Stoich.:	ABCD2E2F14G14 (1)
Weight, g/mol:	349.102704
ΔH_f, kcal/mol:	-96.86
Dipole, Da:	4.4
IP(EA), eV:	-9.13(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-3-fluorophenyl)-3-[(dimethylsulfamoylamino)methyl]-1-methylpyrrolidine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(CNC(=O)NCC2=CSC=C2)O)F)Cl

DOS

IR

Vibrations