Geometry & MOs

Info

ID:	278131
PubChem CID:	103833640
Reduced:	O2S2N3C13H17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	297.103479
ΔH_f, kcal/mol:	-17.8
Dipole, Da:	4.77
IP(EA), eV:	-8.63(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2,2-dimethylcyclopropyl)methylsulfamoyl]benzoate

Drug info:

PubChemData

Smile

C1CSCCN1CCNS(=O)(=O)C2=CC=CC=C2C#N

DOS

IR

Vibrations