Geometry & MOs

Info

ID:	384588
PubChem CID:	134977263
Reduced:	Br2Si2O3C49H62 (1)
Stoich.:	A2B2C3D49E62 (1)
Weight, g/mol:	557.271865
ΔH_f, kcal/mol:	-140.23
Dipole, Da:	1.74
IP(EA), eV:	-8.71(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(9-hexylcarbazol-2-yl)-2,4,5-triphenylcyclopenta-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OCC1=CC=C(C=C1)C2=C(C(=C(C2=O)C3=CC=C(C=C3)CO[Si](C(C)C)(C(C)C)C(C)C)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br

DOS

IR

Vibrations