Geometry & MOs

Info

ID:	78487
PubChem CID:	49693287
Reduced:	FN3O4C21H22 (1)
Stoich.:	AB3C4D21E22 (1)
Weight, g/mol:	404.190006
ΔH_f, kcal/mol:	-105.19
Dipole, Da:	3.97
IP(EA), eV:	-9.64(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-fluorobenzoyl)piperidin-4-yl]methyl]-2-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3F

DOS

IR

Vibrations