Geometry & MOs

Info

ID:	399669
PubChem CID:	135041614
Reduced:	N2O3H10C13 (1)
Stoich.:	A2B3C10D13 (1)
Weight, g/mol:	265.077265
ΔH_f, kcal/mol:	-29.94
Dipole, Da:	3.54
IP(EA), eV:	-8.86(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[2-(2-methylpropyl)-1,3-thiazol-5-yl]furan-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(O1)C2=CN=C3N2C=CC=C3

DOS

IR

Vibrations