Geometry & MOs

Info

ID:	47984
PubChem CID:	10536153
Reduced:	ON3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	202.998535
ΔH_f, kcal/mol:	9.0
Dipole, Da:	3.82
IP(EA), eV:	-7.95(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-carbonochloridoyl-5-methyl-1,2-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)N3CCCC3=N2)N

DOS

IR

Vibrations