Geometry & MOs

Info

ID:	217475
PubChem CID:	85087876
Reduced:	NO3H17C24 (1)
Stoich.:	AB3C17D24 (1)
Weight, g/mol:	367.099063
ΔH_f, kcal/mol:	6.85
Dipole, Da:	2.94
IP(EA), eV:	-9.42(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-cyclopropyl-2-oxo-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-3H-pyridine-5-carboxylate

Drug info:

PubChemData

Smile

C1C2C(N2)C3=C(C=C4C(=C31)C(=O)C5=CC=CC=C5C4=O)OCC6=CC=CC=C6

DOS

IR

Vibrations