Geometry & MOs

Info

ID:

311675

PubChem CID:

126596860

Reduced:

ON3H35C43 (1)

Stoich.:

AB3C35D43 (1)

Weight, g/mol:

619.262363

ΔHf, kcal/mol:

153.85

Dipole, Da:

4.87

IP(EA), eV:

 -7.61(-0.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-carbazol-9-yl-2-[5-[(3E,5Z)-hepta-3,5-dien-1-yn-3-yl]-5a,12b-dihydro-[1]benzofuro[2,3-g]carbazol-3-yl]-N-methylaniline

Drug info:

PubChemData

Smile

CC12C=CC=CC1N(C3=CC=CC=C23)C4=C(CCC(=C4)N)C5=CC6=C(C=C5)C7=C(N6C8=CC=CC=C8)CCC9=C7OC1=CC=CC=C91

DOS

IR

Vibrations