Geometry & MOs

Info

ID:	318748
PubChem CID:	126653027
Reduced:	N3H21C31 (1)
Stoich.:	A3B21C31 (1)
Weight, g/mol:	1378.890472
ΔH_f, kcal/mol:	170.04
Dipole, Da:	0.08
IP(EA), eV:	-8.87(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tris[2-[2-oxo-5-(2,4,4-trimethylpentan-2-yl)-3H-1-benzofuran-3-yl]-4-(2,4,4-trimethylpentan-2-yl)phenyl] phosphite

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C4=CC=CC5=CC=CC=C54)C6=CC=CC=C6

DOS

IR

Vibrations