Geometry & MOs

Info

ID:	306166
PubChem CID:	125001912
Reduced:	SO2N6C16H18 (1)
Stoich.:	AB2C6D16E18 (1)
Weight, g/mol:	359.130363
ΔH_f, kcal/mol:	24.54
Dipole, Da:	10.5
IP(EA), eV:	-8.8(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(2R)-1-(benzenesulfonyl)pyrrolidin-2-yl]pyridin-2-yl]methyl]acetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCC[C@H](C1)C2=NC=C(N=C2)C3=CN=C4N3C=CC=N4

DOS

IR

Vibrations