Geometry & MOs

Info

ID:	249453
PubChem CID:	103089571
Reduced:	NSC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	344.956011
ΔH_f, kcal/mol:	3.91
Dipole, Da:	1.61
IP(EA), eV:	-8.44(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-1-(2,4-dichloro-3-fluorophenyl)sulfonylpyrrolidine

Drug info:

PubChemData

Smile

CC(C)C1=CSC(=N1)C(CCCSC)NC

DOS

IR

Vibrations