Geometry & MOs

Info

ID:	144691
PubChem CID:	53399842
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	357.241627
ΔH_f, kcal/mol:	-17.59
Dipole, Da:	0.48
IP(EA), eV:	-9.2(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-methylpropyl)-2-oxopyrrolidin-1-yl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=NC(=N1)N3CCN(CC3)C=O)CC(CC2=O)C=CC4=CC=CC=C4

DOS

IR

Vibrations