Geometry & MOs

Info

ID:	342199
PubChem CID:	127264912
Reduced:	ClSC2N3H8 (1)
Stoich.:	ABC2D3E8 (1)
Weight, g/mol:	435.194026
ΔH_f, kcal/mol:	-8.99
Dipole, Da:	3.91
IP(EA), eV:	-9.26(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (5E)-5-[1-[2-[5-(diethylsulfamoyl)pyridin-2-yl]hydrazinyl]ethylidene]-2,4-dimethylpyrrole-3-carboxylate

Drug info:

PubChemData

Smile

CSC(=NN)N.Cl

DOS

IR

Vibrations