Geometry & MOs

Info

ID:	441611
PubChem CID:	135237307
Reduced:	N2O5F6C26H28 (1)
Stoich.:	A2B5C6D26E28 (1)
Weight, g/mol:	430.146999
ΔH_f, kcal/mol:	-489.84
Dipole, Da:	6.92
IP(EA), eV:	-8.75(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[7-(3-cyanophenyl)triphenylen-2-yl]benzonitrile

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COCC(C(F)(F)F)OC(=O)N2CCC3(CC2)CC(CO3)C4=NC=C(C=C4)C(F)(F)F

DOS

IR

Vibrations