Geometry & MOs

Info

ID:	316302
PubChem CID:	126630598
Reduced:	NC18H19 (1)
Stoich.:	AB18C19 (1)
Weight, g/mol:	2022.749247
ΔH_f, kcal/mol:	126.05
Dipole, Da:	2.7
IP(EA), eV:	-8.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[2,6-bis[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]pyrimidin-4-yl]-2,7-bis(9-phenylcarbazol-3-yl)carbazole

Drug info:

PubChemData

Smile

C/C=C\1/C=CC=CC2=C3C([C@H]12)C(=C)/C=C\CC(=N3)C

DOS

IR

Vibrations