Geometry & MOs

Info

ID:	70452
PubChem CID:	48413371
Reduced:	N2S2O6C17H26 (1)
Stoich.:	A2B2C6D17E26 (1)
Weight, g/mol:	404.107579
ΔH_f, kcal/mol:	-215.84
Dipole, Da:	6.35
IP(EA), eV:	-9.72(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropylmethyl-[4-(methylsulfamoyl)phenyl]sulfonylamino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(CC1CC1)S(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N(C)C

DOS

IR

Vibrations