Geometry & MOs

Info

ID:	267383
PubChem CID:	103582063
Reduced:	NOCl2F3H6C13 (1)
Stoich.:	ABC2D3E6F13 (1)
Weight, g/mol:	341.979668
ΔH_f, kcal/mol:	-144.5
Dipole, Da:	5.84
IP(EA), eV:	-9.44(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-carbamothioyl-N-(3,5-dichloro-4-fluorophenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)F)C(=O)NC2=CC(=C(C(=C2)Cl)F)Cl

DOS

IR

Vibrations