Geometry & MOs

Info

ID:	268948
PubChem CID:	103602884
Reduced:	ClN2S2O5C9H9 (1)
Stoich.:	AB2C2D5E9F9 (1)
Weight, g/mol:	291.107085
ΔH_f, kcal/mol:	-113.2
Dipole, Da:	4.37
IP(EA), eV:	-10.24(-2.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[(4-fluorophenyl)methyl]-4-methoxy-N-methylbenzamide

Drug info:

PubChemData

Smile

C1C(C(CS1(=O)=O)Cl)NC(=O)C2=CC=C(S2)[N+](=O)[O-]

DOS

IR

Vibrations