Geometry & MOs

Info

ID:	267699
PubChem CID:	103585439
Reduced:	BrClSO4H8C9 (1)
Stoich.:	ABCD4E8F9 (1)
Weight, g/mol:	279.087099
ΔH_f, kcal/mol:	-141.27
Dipole, Da:	5.39
IP(EA), eV:	-10.36(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-difluoro-4-methylphenyl)-4-fluoro-3-methylbenzamide

Drug info:

PubChemData

Smile

COC(=O)CC1=C(C(=CC=C1)Br)S(=O)(=O)Cl

DOS

IR

Vibrations