Geometry & MOs

Info

ID:	267785
PubChem CID:	103589227
Reduced:	BrON3C10H10 (1)
Stoich.:	ABC3D10E10 (1)
Weight, g/mol:	321.01129
ΔH_f, kcal/mol:	26.89
Dipole, Da:	2.84
IP(EA), eV:	-8.86(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-amino-5-bromophenoxy)-1-cyclopropylpyrazin-2-one

Drug info:

PubChemData

Smile

CN1C=CN=C1OC2=CC(=CC(=C2)N)Br

DOS

IR

Vibrations