Geometry & MOs

Info

ID:	396030
PubChem CID:	135027223
Reduced:	N2C3H5 (4)
Stoich.:	A2B3C5 (4)
Weight, g/mol:	154.062994
ΔH_f, kcal/mol:	69.87
Dipole, Da:	3.57
IP(EA), eV:	-8.36(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,6S)-7-oxabicyclo[4.1.0]hept-2-ene-2-carboxylate

Drug info:

PubChemData

Smile

C1C2/C(=N/N=C(N)N)/C3/C(=N\N=C(N)N)/C(C2)CC1C3

DOS

IR

Vibrations