Geometry & MOs

Info

ID:	292134
PubChem CID:	114465534
Reduced:	SN2O6C10H18 (1)
Stoich.:	AB2C6D10E18 (1)
Weight, g/mol:	311.093977
ΔH_f, kcal/mol:	-270.33
Dipole, Da:	3.72
IP(EA), eV:	-10.32(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[[4-(3-aminoprop-1-ynyl)-2-methylphenyl]sulfamoyl]carbamate

Drug info:

PubChemData

Smile

CC(C)OC(=O)NS(=O)(=O)N1CCC(C1)C(=O)OC

DOS

IR

Vibrations