Geometry & MOs

Info

ID:	294950
PubChem CID:	117509022
Reduced:	BrN2O3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	326.0266
ΔH_f, kcal/mol:	-47.34
Dipole, Da:	3.95
IP(EA), eV:	-8.82(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-bromo-2,3-dimethoxy-4,6-dimethylphenyl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC(=C1C2=C(ON=C2)N)Br)OC

DOS

IR

Vibrations