Geometry & MOs

Info

ID:	345496
PubChem CID:	127269796
Reduced:	N3O4C15H19 (1)
Stoich.:	A3B4C15D19 (1)
Weight, g/mol:	289.146013
ΔH_f, kcal/mol:	-141.58
Dipole, Da:	3.21
IP(EA), eV:	-8.87(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-methylsulfonylpiperidin-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OCO2)NC(=O)NC3CCCNC3=O

DOS

IR

Vibrations