Geometry & MOs

Info

ID:	170371
PubChem CID:	75222137
Reduced:	S2O3N4H22C23 (1)
Stoich.:	A2B3C4D22E23 (1)
Weight, g/mol:	364.142307
ΔH_f, kcal/mol:	1.76
Dipole, Da:	5.57
IP(EA), eV:	-8.63(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl 3-(4-methoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C2=NN=C(O2)SCC3NC4C(C(=CS4)C5=CC=CC=C5)C(=O)N3

DOS

IR

Vibrations