Geometry & MOs

Info

ID:	257260
PubChem CID:	103144749
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	253.088498
ΔH_f, kcal/mol:	-122.57
Dipole, Da:	6.61
IP(EA), eV:	-8.36(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-1-cyanoethanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NS(=O)(=O)CCCOC)C)N

DOS

IR

Vibrations