Geometry & MOs

Info

ID:	32411
PubChem CID:	7790959
Reduced:	NO3C8H10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	332.046693
ΔH_f, kcal/mol:	-221.21
Dipole, Da:	5.74
IP(EA), eV:	-8.57(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl 4-oxo-4-thiophen-2-ylbutanoate

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C/C(=O)O[C@H](C)C(=O)NC(=O)N)OC

DOS

IR

Vibrations