Geometry & MOs

Info

ID:	405636
PubChem CID:	135074744
Reduced:	SN2O2C11H12 (2)
Stoich.:	AB2C2D11E12 (2)
Weight, g/mol:	334.214409
ΔH_f, kcal/mol:	-23.23
Dipole, Da:	11.3
IP(EA), eV:	-9.38(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 8-(3-methylidenepent-4-enyl)spiro[2.5]octane-2,2-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(N=N2)CN(CC=C3CC3)S(=O)(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations