Geometry & MOs

Info

ID:	295283
PubChem CID:	117524877
Reduced:	BrN2O2H11C14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	307.9352
ΔH_f, kcal/mol:	5.18
Dipole, Da:	6.15
IP(EA), eV:	-9.0(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-(2-chlorophenyl)-[1,3]oxazolo[4,5-b]pyridine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2=NC3=C(O2)C=CC(=N3)Br

DOS

IR

Vibrations