Geometry & MOs

Info

ID:

442169

PubChem CID:

135250234

Reduced:

ON2H12C17 (2)

Stoich.:

AB2C12D17 (2)

Weight, g/mol:

608.206839

ΔHf, kcal/mol:

104.75

Dipole, Da:

0.33

IP(EA), eV:

 -8.66(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-[7-[5-(4,4-dimethyl-5H-1,3-thiazol-2-yl)pyridin-2-yl]triphenylen-2-yl]pyridin-3-yl]-4,4-dimethyl-5H-1,3-thiazole

Drug info:

PubChemData

Smile

C1COC(=N1)C2=CC=CC(=N2)C3=CC4=C(C=C3)C5=C(C=C(C=C5)C6=NC(=CC=C6)C7=NCCO7)C8=CC=CC=C84

DOS

IR

Vibrations