Geometry & MOs

Info

ID:	404674
PubChem CID:	135069156
Reduced:	NO5C17H21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	274.120509
ΔH_f, kcal/mol:	-164.29
Dipole, Da:	3.0
IP(EA), eV:	-8.42(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 11-methyltricyclo[6.2.1.02,7]undeca-2,4,6-triene-9,9-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C3CCC(O2)CC3(C(=O)OC)C(=O)OC

DOS

IR

Vibrations