Geometry & MOs

Info

ID:	259279
PubChem CID:	103162395
Reduced:	O2C17H18 (1)
Stoich.:	A2B17C18 (1)
Weight, g/mol:	231.089543
ΔH_f, kcal/mol:	-39.71
Dipole, Da:	4.71
IP(EA), eV:	-8.7(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-cyclobutylacetyl)-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)C(=O)CC3CCC3

DOS

IR

Vibrations