Geometry & MOs

Info

ID:	285656
PubChem CID:	104116108
Reduced:	ClNO3C8H12 (1)
Stoich.:	ABC3D8E12 (1)
Weight, g/mol:	251.071306
ΔH_f, kcal/mol:	-99.11
Dipole, Da:	4.07
IP(EA), eV:	-9.43(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(chloromethyl)-2-(3-phenylpropoxy)-1,3-oxazole

Drug info:

PubChemData

Smile

COCCCOC1=NC(=CO1)CCl

DOS

IR

Vibrations