Geometry & MOs

Info

ID:	349806
PubChem CID:	127276198
Reduced:	NSO3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	252.183778
ΔH_f, kcal/mol:	-151.84
Dipole, Da:	6.94
IP(EA), eV:	-9.62(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-ethylpyrrolidine-1-carbonyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCC1CCCN1C(=O)C2CCS(=O)(=O)C2

DOS

IR

Vibrations