Geometry & MOs

Info

ID:	442090
PubChem CID:	135249749
Reduced:	SN2H32C44 (1)
Stoich.:	AB2C32D44 (1)
Weight, g/mol:	696.314064
ΔH_f, kcal/mol:	179.87
Dipole, Da:	0.87
IP(EA), eV:	-8.24(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,5,5-tetramethyl-2-[5-(9-naphthalen-2-yl-7,7-diphenylbenzo[c]fluoren-5-yl)pyridin-2-yl]-1,3-oxazole

Drug info:

PubChemData

Smile

CC1(CSC(=N1)C2=CC=CC(=N2)C3=CC4=C(C5=CC=CC=C5C(=C4C=C3)C6=CC7=CC=CC=C7C=C6)C8=CC9=CC=CC=C9C=C8)C

DOS

IR

Vibrations