Geometry & MOs

Info

ID:	152693
PubChem CID:	56311724
Reduced:	NSF3O4C18H18 (1)
Stoich.:	ABC3D4E18F18 (1)
Weight, g/mol:	369.06017
ΔH_f, kcal/mol:	-273.15
Dipole, Da:	8.7
IP(EA), eV:	-8.89(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-fluorophenyl)sulfonyl-3-(4-methoxyphenyl)pyrrolidine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2CCN(C2)S(=O)(=O)C3=CC=CC=C3OC(F)(F)F

DOS

IR

Vibrations