Geometry & MOs

Info

ID:	269069
PubChem CID:	103609803
Reduced:	Cl2N3O3H7C12 (1)
Stoich.:	A2B3C3D7E12 (1)
Weight, g/mol:	395.991
ΔH_f, kcal/mol:	-30.14
Dipole, Da:	3.64
IP(EA), eV:	-8.82(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-chloro-5-(dimethylsulfamoyl)phenyl]pentanamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC(=NN=C3Cl)Cl

DOS

IR

Vibrations