Geometry & MOs

Info

ID:	140487
PubChem CID:	52708010
Reduced:	BrON2S2H15C16 (1)
Stoich.:	ABC2D2E15F16 (1)
Weight, g/mol:	383.224263
ΔH_f, kcal/mol:	16.93
Dipole, Da:	4.04
IP(EA), eV:	-8.96(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-(diethylamino)ethyl-(2-methylpropyl)sulfamoyl]-4-methylphenyl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(S1)NC(=O)CSC2=C(C=C(C=C2)Br)C)C#N

DOS

IR

Vibrations