Geometry & MOs

Info

ID:	50245
PubChem CID:	12012760
Reduced:	BO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	501.859091
ΔH_f, kcal/mol:	-244.74
Dipole, Da:	5.01
IP(EA), eV:	-9.43(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-nitro-2-[(2-nitrophenyl)ditellanyl]benzene

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)CC2=CC=C(C=C2)C(=O)OC

DOS

IR

Vibrations