Geometry & MOs

Info

ID:	392555
PubChem CID:	135017147
Reduced:	SN2O2H28C31 (1)
Stoich.:	AB2C2D28E31 (1)
Weight, g/mol:	320.028935
ΔH_f, kcal/mol:	54.69
Dipole, Da:	5.37
IP(EA), eV:	-8.26(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-oxo-2,4-dithiophen-2-yl-1H-imidazole-2-carboxylate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)N(CC#CC3=CC=CC(=C3)C)S(=O)(=O)C4=CC=C(C=C4)C)C5=CC=CC=C51

DOS

IR

Vibrations