Geometry & MOs

Info

ID:	292133
PubChem CID:	114465525
Reduced:	NS2O5C12H17 (1)
Stoich.:	AB2C5D12E17 (1)
Weight, g/mol:	294.088557
ΔH_f, kcal/mol:	-168.93
Dipole, Da:	3.66
IP(EA), eV:	-9.74(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(propan-2-yloxycarbonylsulfamoyl)pyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCCOCC(=C)C)C(=O)O

DOS

IR

Vibrations