Geometry & MOs

Info

ID:	376270
PubChem CID:	134222280
Reduced:	ClFO3N8H22C25 (1)
Stoich.:	ABC3D8E22F25 (1)
Weight, g/mol:	1411.538251
ΔH_f, kcal/mol:	-17.57
Dipole, Da:	11.91
IP(EA), eV:	-9.16(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,5-tris(3,6-diphenylcarbazol-9-yl)-6-[(3,6-diphenylcarbazol-9-yl)methyl]benzene-1,4-dicarbonitrile

Drug info:

PubChemData

Smile

C1[C@H](CN([C@@H]1C(=O)NC2=NC(=CC=C2)Cl)CCN3C4=C(C=C(C=C4)C5=CN=C(N=C5)C=O)C(=N3)C(=O)N)F

DOS

IR

Vibrations