Geometry & MOs

Info

ID:	285658
PubChem CID:	104116243
Reduced:	ClN2O2H9C10 (1)
Stoich.:	AB2C2D9E10 (1)
Weight, g/mol:	187.040006
ΔH_f, kcal/mol:	-13.53
Dipole, Da:	2.7
IP(EA), eV:	-9.57(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)OC2=NC(=CO2)CCl

DOS

IR

Vibrations