Geometry & MOs

Info

ID:	252745
PubChem CID:	103113731
Reduced:	SO2N5C13H17 (1)
Stoich.:	AB2C5D13E17 (1)
Weight, g/mol:	280.099397
ΔH_f, kcal/mol:	-31.47
Dipole, Da:	6.78
IP(EA), eV:	-8.52(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(2-methyl-1,3-thiazol-5-yl)methyl]-5-propyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)C1=C(C2=C(S1)N=NC=C2)N

DOS

IR

Vibrations