Geometry & MOs

Info

ID:	278242
PubChem CID:	103834311
Reduced:	SN2O3C12H28 (1)
Stoich.:	AB2C3D12E28 (1)
Weight, g/mol:	281.129694
ΔH_f, kcal/mol:	-166.56
Dipole, Da:	5.86
IP(EA), eV:	-9.62(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(2-hydroxy-4-methylpentyl)sulfamoyl]propanoate

Drug info:

PubChemData

Smile

CCCN(CCC)S(=O)(=O)NCC(CC(C)C)O

DOS

IR

Vibrations