Geometry & MOs

Info

ID:	195929
PubChem CID:	78749967
Reduced:	FO5H17C19 (1)
Stoich.:	AB5C17D19 (1)
Weight, g/mol:	387.071134
ΔH_f, kcal/mol:	-175.73
Dipole, Da:	3.12
IP(EA), eV:	-8.52(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[phenyl(thiophen-2-yl)methyl]amino]ethyl] 4-ethylthiadiazole-5-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C=CC(=O)OCC(=O)C2=CC(=CC=C2)F

DOS

IR

Vibrations