Geometry & MOs

Info

ID:	294775
PubChem CID:	117489945
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	303.9659
ΔH_f, kcal/mol:	-72.61
Dipole, Da:	3.53
IP(EA), eV:	-8.55(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromo-2,5-difluoro-6-methoxyphenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC2CCNCC2)CN3CCOCC3

DOS

IR

Vibrations