Geometry & MOs

Info

ID:	387009
PubChem CID:	134983667
Reduced:	O4H18C21 (1)
Stoich.:	A4B18C21 (1)
Weight, g/mol:	558.234751
ΔH_f, kcal/mol:	-50.5
Dipole, Da:	3.85
IP(EA), eV:	-9.32(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2,3-diphenylcycloprop-2-en-1-ylidene)-2,4,5-triphenylcyclopenta-1,4-dien-1-yl]benzene

Drug info:

PubChemData

Smile

COC(=O)CC(=C1C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

DOS

IR

Vibrations