Geometry & MOs

Info

ID:	303212
PubChem CID:	124489363
Reduced:	SN2O3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	298.135114
ΔH_f, kcal/mol:	-106.31
Dipole, Da:	5.2
IP(EA), eV:	-8.98(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-1-(2-methoxy-5-methylphenyl)sulfonylpyrrolidin-3-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC[C@@H](C2)CNC

DOS

IR

Vibrations