Geometry & MOs

Info

ID:	276532
PubChem CID:	103824150
Reduced:	BrSN2O3C13H19 (1)
Stoich.:	ABC2D3E13F19 (1)
Weight, g/mol:	309.114713
ΔH_f, kcal/mol:	-121.02
Dipole, Da:	3.47
IP(EA), eV:	-8.83(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-cyano-2-methylphenyl)sulfonylamino]-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NCC(C)(C)C(=O)NC)Br

DOS

IR

Vibrations