Geometry & MOs

Info

ID:	63552
PubChem CID:	26758607
Reduced:	ClFNO4H19C20 (1)
Stoich.:	ABCD4E19F20 (1)
Weight, g/mol:	424.04563
ΔH_f, kcal/mol:	-189.42
Dipole, Da:	4.91
IP(EA), eV:	-9.41(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[5-(diethylsulfamoyl)-2-methylphenyl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCC1=CC=CC=C1Cl)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations