Geometry & MOs

Info

ID:	30597
PubChem CID:	841555
Reduced:	NO6C17H19 (1)
Stoich.:	AB6C17D19 (1)
Weight, g/mol:	337.062008
ΔH_f, kcal/mol:	-228.27
Dipole, Da:	5.33
IP(EA), eV:	-9.06(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-O-ethyl 2-O-methyl 5-(furan-2-carbonylamino)-3-methylthiophene-2,4-dicarboxylate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)[C@@H]2C(=C(C(=O)N2CCC(=O)O)O)C(=O)C

DOS

IR

Vibrations