Geometry & MOs

Info

ID:	4104
PubChem CID:	10772
Reduced:	NO3H7C8 (1)
Stoich.:	AB3C7D8 (1)
Weight, g/mol:	165.042593
ΔH_f, kcal/mol:	-85.49
Dipole, Da:	6.37
IP(EA), eV:	-8.87(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC(=O)O2

DOS

IR

Vibrations