Geometry & MOs

Info

ID:	415
PubChem CID:	2734
Reduced:	ClNO3H4C7 (1)
Stoich.:	ABC3D4E7 (1)
Weight, g/mol:	184.987971
ΔH_f, kcal/mol:	-95.92
Dipole, Da:	1.93
IP(EA), eV:	-9.08(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-6-hydroxy-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

C1=C2C(=CC(=C1Cl)O)OC(=O)N2

DOS

IR

Vibrations