Geometry & MOs

Info

ID:	303241
PubChem CID:	124489402
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	306.060505
ΔH_f, kcal/mol:	-29.51
Dipole, Da:	7.93
IP(EA), eV:	-9.18(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-1-(3-chloro-2-fluorophenyl)sulfonylpyrrolidin-3-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNC[C@H]1CCN(C1)S(=O)(=O)CC2=CC(=CC=C2)C#N

DOS

IR

Vibrations