Geometry & MOs

Info

ID:	280622
PubChem CID:	103850316
Reduced:	SO2N3C12H13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	246.140199
ΔH_f, kcal/mol:	-12.05
Dipole, Da:	7.46
IP(EA), eV:	-8.66(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(7-methyloctyl)methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCNS(=O)(=O)CC#N

DOS

IR

Vibrations