Geometry & MOs

Info

ID:	316259
PubChem CID:	126630492
Reduced:	NO2C8H17 (1)
Stoich.:	AB2C8D17 (1)
Weight, g/mol:	2072.764897
ΔH_f, kcal/mol:	-114.68
Dipole, Da:	2.65
IP(EA), eV:	-9.74(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]([C@@H](C(=O)OC)N)C(C)C

DOS

IR

Vibrations