Geometry & MOs

Info

ID:	236374
PubChem CID:	92712555
Reduced:	N3O7C19H19 (1)
Stoich.:	A3B7C19D19 (1)
Weight, g/mol:	521.179815
ΔH_f, kcal/mol:	-115.09
Dipole, Da:	3.3
IP(EA), eV:	-8.3(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2S)-3-acetyl-5-(6-methylpyridin-3-yl)-2H-1,3,4-oxadiazol-2-yl]-2-methoxyphenyl] 3,4,5-trimethoxybenzoate

Drug info:

PubChemData

Smile

CC(=O)N1[C@@H](OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C(=C3)OC)OC)OC

DOS

IR

Vibrations