Geometry & MOs

Info

ID:	303345
PubChem CID:	124489547
Reduced:	BrSN2O3C12H17 (1)
Stoich.:	ABC2D3E12F17 (1)
Weight, g/mol:	270.103814
ΔH_f, kcal/mol:	-91.71
Dipole, Da:	5.44
IP(EA), eV:	-8.99(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-methyl-N-[(3R)-pyrrolidin-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN([C@H]1CCNC1)S(=O)(=O)C2=C(C=CC(=C2)Br)OC

DOS

IR

Vibrations