Geometry & MOs

Info

ID:	363493
PubChem CID:	127311544
Reduced:	FO2N4C21H29 (1)
Stoich.:	AB2C4D21E29 (1)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-96.51
Dipole, Da:	2.66
IP(EA), eV:	-8.84(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclohexyl)-2-[[1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-methylamino]-N-methylacetamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CCN(CC1)C2CC2)C3CCN(C3=O)C4=CC=CC=C4F

DOS

IR

Vibrations