Geometry & MOs

Info

ID:	155884
PubChem CID:	56368102
Reduced:	BrN4O4H19C21 (1)
Stoich.:	AB4C4D19E21 (1)
Weight, g/mol:	462.112854
ΔH_f, kcal/mol:	-70.58
Dipole, Da:	7.69
IP(EA), eV:	-9.35(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(tert-butylsulfamoyl)-N-(3-chloro-4-imidazol-1-ylphenyl)-4-methoxybenzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC(=O)C2=CC=C(O2)Br)C(=O)NCCC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations