Geometry & MOs

Info

ID:	367034
PubChem CID:	127322966
Reduced:	SN3O3C14H21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	323.220892
ΔH_f, kcal/mol:	-113.76
Dipole, Da:	4.86
IP(EA), eV:	-10.09(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NC=C(C(=N1)C(C)C)C(=O)N2CCCS(=O)(=O)CC2

DOS

IR

Vibrations