Geometry & MOs

Info

ID:	393051
PubChem CID:	135019155
Reduced:	O4H26C31 (1)
Stoich.:	A4B26C31 (1)
Weight, g/mol:	442.214409
ΔH_f, kcal/mol:	-75.78
Dipole, Da:	2.69
IP(EA), eV:	-9.1(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzyl 5-butyl-1,3-dihydroindene-2,2-dicarboxylate

Drug info:

PubChemData

Smile

C1C2=C(CC1(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)C=C(C=C2)C5=CC=CC=C5

DOS

IR

Vibrations