Geometry & MOs

Info

ID:	342037
PubChem CID:	127264750
Reduced:	ClFON4H10C14 (1)
Stoich.:	ABCD4E10F14 (1)
Weight, g/mol:	291.104148
ΔH_f, kcal/mol:	29.76
Dipole, Da:	7.5
IP(EA), eV:	-9.47(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[2-(2-ethylpyrazol-3-yl)ethenyl]-4-methyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CN1C2=NC(=NC(=O)C2=CN1)C=CC3=C(C=CC(=C3)Cl)F

DOS

IR

Vibrations