Geometry & MOs

Info

ID:	37476
PubChem CID:	8021480
Reduced:	ClFN2O4H12C18 (1)
Stoich.:	ABC2D4E12F18 (1)
Weight, g/mol:	314.050986
ΔH_f, kcal/mol:	-68.8
Dipole, Da:	5.62
IP(EA), eV:	-9.03(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloronaphthalen-1-yl)oxy-1-(2-fluorophenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=C2Cl)OCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])F

DOS

IR

Vibrations