Geometry & MOs

Info

ID:	303256
PubChem CID:	124489423
Reduced:	SN2O2F3C12H15 (1)
Stoich.:	AB2C2D3E12F15 (1)
Weight, g/mol:	290.090055
ΔH_f, kcal/mol:	-201.14
Dipole, Da:	3.24
IP(EA), eV:	-8.97(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-1-(3,4-difluorophenyl)sulfonylpyrrolidin-3-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNC[C@@H]1CCN(C1)S(=O)(=O)C2=C(C=C(C=C2F)F)F

DOS

IR

Vibrations