Geometry & MOs

Info

ID:	63232
PubChem CID:	26750231
Reduced:	BrSN2O4H19C20 (1)
Stoich.:	ABC2D4E19F20 (1)
Weight, g/mol:	412.085971
ΔH_f, kcal/mol:	-83.27
Dipole, Da:	4.76
IP(EA), eV:	-8.68(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenoxy)-N-[4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]phenyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)OC(=O)/C=C/C3=CC=C(O3)Br

DOS

IR

Vibrations