Geometry & MOs

Info

ID:	156210
PubChem CID:	56369566
Reduced:	SN2O3C24H32 (1)
Stoich.:	AB2C3D24E32 (1)
Weight, g/mol:	454.058104
ΔH_f, kcal/mol:	-108.31
Dipole, Da:	7.48
IP(EA), eV:	-9.24(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(5,6-difluoro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-3-(dimethylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

CCCC(C1=CC=CC=C1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations