Geometry & MOs

Info

ID:	244241
PubChem CID:	99319556
Reduced:	ClFN2O3H20C22 (1)
Stoich.:	ABC2D3E20F22 (1)
Weight, g/mol:	380.153621
ΔH_f, kcal/mol:	-123.24
Dipole, Da:	4.94
IP(EA), eV:	-8.72(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-(3-fluorophenyl)acetyl]amino]ethyl]-4-methoxynaphthalene-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=C2Cl)OCC(=O)NCCNC(=O)CC3=CC(=CC=C3)F

DOS

IR

Vibrations