Geometry & MOs

Info

ID:	329902
PubChem CID:	127246769
Reduced:	SO2N3C13H21 (1)
Stoich.:	AB2C3D13E21 (1)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	-63.82
Dipole, Da:	3.01
IP(EA), eV:	-8.51(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]-2-phenoxyethanone

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCCC1C2=CC(=NC=C2)N(C)C

DOS

IR

Vibrations