Geometry & MOs

Info

ID:	280631
PubChem CID:	103850384
Reduced:	SO2N3C9H19 (1)
Stoich.:	AB2C3D9E19 (1)
Weight, g/mol:	219.067762
ΔH_f, kcal/mol:	-63.41
Dipole, Da:	5.55
IP(EA), eV:	-8.96(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyanomethylsulfonylamino)-3-methylbutanamide

Drug info:

PubChemData

Smile

CCC(C)N(C)CCNS(=O)(=O)CC#N

DOS

IR

Vibrations