Geometry & MOs

Info

ID:	236441
PubChem CID:	92712973
Reduced:	ClO3N4H19C23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	519.134969
ΔH_f, kcal/mol:	-18.99
Dipole, Da:	2.38
IP(EA), eV:	-8.97(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2R)-3-acetyl-5-anthracen-9-yl-2H-1,3,4-oxadiazol-2-yl]phenyl]-2-chlorobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations