Geometry & MOs

Info

ID:	203906
PubChem CID:	79890367
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	246.07529
ΔH_f, kcal/mol:	38.03
Dipole, Da:	2.54
IP(EA), eV:	-8.26(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-amino-1,3-benzoxazol-2-yl)piperazine-2,6-dione

Drug info:

PubChemData

Smile

C1CC1C(CNC2=NC3=C(O2)C=CC(=C3)N)C4CC4

DOS

IR

Vibrations