Geometry & MOs

Info

ID:	246717
PubChem CID:	103064727
Reduced:	SN3O3C12H15 (1)
Stoich.:	AB3C3D12E15 (1)
Weight, g/mol:	250.113984
ΔH_f, kcal/mol:	-31.75
Dipole, Da:	9.94
IP(EA), eV:	-8.46(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-(methylamino)-N-(thiolan-3-yl)benzamide

Drug info:

PubChemData

Smile

CNC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2CCSC2

DOS

IR

Vibrations