Geometry & MOs

Info

ID:	246729
PubChem CID:	103064744
Reduced:	OS2N4C9H14 (1)
Stoich.:	AB2C4D9E14 (1)
Weight, g/mol:	295.099063
ΔH_f, kcal/mol:	-3.12
Dipole, Da:	6.37
IP(EA), eV:	-8.62(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethylamino)-3-nitro-N-(thiolan-3-yl)benzamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)C(=O)NC2CCSC2

DOS

IR

Vibrations