Geometry & MOs

Info

ID:	294949
PubChem CID:	117508089
Reduced:	BrNO3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	326.0266
ΔH_f, kcal/mol:	-83.95
Dipole, Da:	4.05
IP(EA), eV:	-8.8(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-bromo-3-methoxy-2-propan-2-yloxyphenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1Br)CN=C=O)OC2CCCC2

DOS

IR

Vibrations