Geometry & MOs

Info

ID:

442207

PubChem CID:

135250554

Reduced:

N2C23H25 (2)

Stoich.:

A2B23C25 (2)

Weight, g/mol:

655.294725

ΔHf, kcal/mol:

96.51

Dipole, Da:

2.4

IP(EA), eV:

 -8.55(-0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3-[4-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-6-(3,5-diphenylphenyl)-1,3,5-triazin-2-yl]phenyl]-4,4-dimethyl-5H-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=NC(C(N1C2=CC=CC(=C2)C3=CC(=CC(=C3)C4=CC=CC(=C4)C5=CC=CC=C5)C6=CC(=CC=C6)N7C(=NC(C7(C)C)(C)C)C)(C)C)(C)C

DOS

IR

Vibrations