Geometry & MOs

Info

ID:	23355
PubChem CID:	603186
Reduced:	BrN2O3H9C15 (1)
Stoich.:	AB2C3D9E15 (1)
Weight, g/mol:	343.97965
ΔH_f, kcal/mol:	71.82
Dipole, Da:	1.59
IP(EA), eV:	-9.96(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromophenyl)-4-nitro-3-phenyl-1,2-oxazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NOC(=C2[N+](=O)[O-])C3=CC=C(C=C3)Br

DOS

IR

Vibrations