Geometry & MOs

Info

ID:	35966
PubChem CID:	7980570
Reduced:	FSN2O4C19H21 (1)
Stoich.:	ABC2D4E19F21 (1)
Weight, g/mol:	334.120509
ΔH_f, kcal/mol:	-171.25
Dipole, Da:	5.92
IP(EA), eV:	-9.01(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-ethoxyphenyl)-2-oxoethyl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)F)C)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations