Geometry & MOs

Info

ID:	303032
PubChem CID:	124489126
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	308.080633
ΔH_f, kcal/mol:	-64.78
Dipole, Da:	6.58
IP(EA), eV:	-9.1(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[2-(trifluoromethyl)phenyl]sulfonylpyrrolidin-2-yl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)S(=O)(=O)N2CCC[C@@H]2CN

DOS

IR

Vibrations