Geometry & MOs

Info

ID:	60774
PubChem CID:	26701997
Reduced:	BrSN2O4H17C21 (1)
Stoich.:	ABC2D4E17F21 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-86.42
Dipole, Da:	2.47
IP(EA), eV:	-8.69(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(methylsulfamoyl)-N-[(2S)-2-phenylbutyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCNC(=O)C3=CC=CS3)Br

DOS

IR

Vibrations