Geometry & MOs

Info

ID:	441821
PubChem CID:	135245381
Reduced:	N2H22C27 (1)
Stoich.:	A2B22C27 (1)
Weight, g/mol:	529.226646
ΔH_f, kcal/mol:	154.03
Dipole, Da:	2.82
IP(EA), eV:	-8.65(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[6-[(3E,5Z)-hepta-1,3,5-trien-3-yl]pyridazin-3-yl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C/C=C(/C2=CC3=C(C=C2)C4=CC=CC(=C4)C5=CC=CC=C5N3)\N

DOS

IR

Vibrations