Geometry & MOs

Info

ID:	52908
PubChem CID:	14709186
Reduced:	C8H9 (2)
Stoich.:	A8B9 (2)
Weight, g/mol:	450.21737
ΔH_f, kcal/mol:	32.09
Dipole, Da:	0.07
IP(EA), eV:	-8.38(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,8S,13R,17S)-9,9,18,18-tetramethyl-6,15-diphenyl-5,7,14,16-tetraoxa-6,15-diborapentacyclo[10.6.0.03,10.04,8.013,17]octadeca-1(12),2,10-triene

Drug info:

PubChemData

Smile

CC1(C=CC2=CC3=C(C=CC3(C)C)C=C21)C

DOS

IR

Vibrations