Geometry & MOs

Info

ID:	236375
PubChem CID:	92712563
Reduced:	N3O8C27H27 (1)
Stoich.:	A3B8C27D27 (1)
Weight, g/mol:	392.11207
ΔH_f, kcal/mol:	-196.09
Dipole, Da:	5.11
IP(EA), eV:	-8.46(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-5-(6-methylpyridin-3-yl)-2-[5-(3-nitrophenyl)furan-2-yl]-2H-1,3,4-oxadiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)C2=NN([C@@H](O2)C3=CC(=C(C=C3)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC)OC)C(=O)C

DOS

IR

Vibrations