Geometry & MOs

Info

ID:	134476
PubChem CID:	51702537
Reduced:	ClNSO4H16C19 (1)
Stoich.:	ABCD4E16F19 (1)
Weight, g/mol:	392.95447
ΔH_f, kcal/mol:	-101.83
Dipole, Da:	8.17
IP(EA), eV:	-9.01(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4-bromophenyl)-(2-methyl-1,3-dioxoisoindol-5-yl)sulfonylazanide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC3=C2C(=CC=C3)Cl

DOS

IR

Vibrations