Geometry & MOs

Info

ID:	236426
PubChem CID:	92712817
Reduced:	BrN2O2H15C20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	341.101171
ΔH_f, kcal/mol:	18.97
Dipole, Da:	5.03
IP(EA), eV:	-9.03(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](OC(=N1)C2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)Br

DOS

IR

Vibrations