Geometry & MOs

Info

ID:

442150

PubChem CID:

135250122

Reduced:

NH11C12 (5)

Stoich.:

AB11C12 (5)

Weight, g/mol:

585.216475

ΔHf, kcal/mol:

196.24

Dipole, Da:

1.07

IP(EA), eV:

 -8.09(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-[9-[5-(4,5-dihydro-1,3-oxazol-2-yl)pyridin-2-yl]-7-phenylbenzo[c]carbazol-5-yl]pyridin-3-yl]-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

Smile

CC1(C(N(C(=N1)C2=CC=CC(=C2)C3=CC4=C(C=C3)C5=C(N4C6=CC=CC=C6)C=C(C7=CC=CC=C75)C8=CC(=CC=C8)C9=NC(C(N9C1=CC=CC=C1)(C)C)(C)C)C1=CC=CC=C1)(C)C)C

DOS

IR

Vibrations