Geometry & MOs

Info

ID:	253015
PubChem CID:	103115485
Reduced:	SO2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	284.074325
ΔH_f, kcal/mol:	-0.77
Dipole, Da:	3.53
IP(EA), eV:	-9.14(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-(2,4-dimethyl-1,3-thiazol-5-yl)-1-(2-fluoroethyl)triazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C2=C(N=NN2CCC3CC3)C(=O)OC

DOS

IR

Vibrations