Geometry & MOs

Info

ID:	51101
PubChem CID:	12013725
Reduced:	OH16C22 (1)
Stoich.:	AB16C22 (1)
Weight, g/mol:	540.20893
ΔH_f, kcal/mol:	60.93
Dipole, Da:	1.42
IP(EA), eV:	-8.41(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R,2R,3R,4R)-2-benzo[e][1]benzofuran-2-yl-3,4-diphenylcyclobutyl]benzo[e][1]benzofuran

Drug info:

PubChemData

Smile

C=CC1=C2C=C[C@H]3[C@@H](C2=CC=C1)C4=C(O3)C=CC5=CC=CC=C54

DOS

IR

Vibrations