Geometry & MOs

Info

ID:	442167
PubChem CID:	135250229
Reduced:	N7H21C22 (1)
Stoich.:	A7B21C22 (1)
Weight, g/mol:	576.252526
ΔH_f, kcal/mol:	162.39
Dipole, Da:	3.25
IP(EA), eV:	-8.54(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CC=C(C=C2)C3=C4C(=NC=CN4N=C3)N5CCC(CC5)C#N

DOS

IR

Vibrations