Geometry & MOs

Info

ID:	386957
PubChem CID:	134983506
Reduced:	CoN2O7H25C27 (1)
Stoich.:	AB2C7D25E27 (1)
Weight, g/mol:	484.224974
ΔH_f, kcal/mol:	-159.9
Dipole, Da:	30.43
IP(EA), eV:	-10.12(-6.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzyl 4,7-dimethyl-2'-oxospiro[3,5-dihydro-1H-indene-6,1'-cyclopentane]-2,2-dicarboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=C([C@@H]2[C@@H]3C(=C1)CCCN3C(=O)N(C2=O)C(=O)C4=CC=CC=C4)C(=O)OC.C1=C[CH]C=C1.[Co]

DOS

IR

Vibrations