Geometry & MOs

Info

ID:	318615
PubChem CID:	126652291
Reduced:	FN4C28H35 (1)
Stoich.:	AB4C28D35 (1)
Weight, g/mol:	1425.528749
ΔH_f, kcal/mol:	8.2
Dipole, Da:	6.61
IP(EA), eV:	-8.45(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[2-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)C2=C(C=CC(=C2F)N(C3=C(C4=C(N3)C=C(C=C4)C#N)C)C(C)C)C

DOS

IR

Vibrations