Geometry & MOs

Info

ID:	236395
PubChem CID:	92712692
Reduced:	Cl2N3O6H13C18 (1)
Stoich.:	A2B3C6D13E18 (1)
Weight, g/mol:	379.012661
ΔH_f, kcal/mol:	-101.56
Dipole, Da:	4.79
IP(EA), eV:	-9.38(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations