Geometry & MOs

Info

ID:	337101
PubChem CID:	127256666
Reduced:	NO6C13H15 (1)
Stoich.:	AB6C13D15 (1)
Weight, g/mol:	236.104859
ΔH_f, kcal/mol:	-139.03
Dipole, Da:	3.35
IP(EA), eV:	-8.76(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2H-pyran-3-yl 2-methoxycyclohex-2-ene-1-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(CCC1C(=O)OC2=CC=COC2)[N+](=O)[O-]

DOS

IR

Vibrations