Geometry & MOs

Info

ID:	353166
PubChem CID:	127284346
Reduced:	NOC15H19 (1)
Stoich.:	ABC15D19 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-36.93
Dipole, Da:	4.74
IP(EA), eV:	-9.03(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylbutanamide

Drug info:

PubChemData

Smile

CC1CCN(C1)C(=O)C2CCC3=CC=CC=C23

DOS

IR

Vibrations