Geometry & MOs

Info

ID:	1210
PubChem CID:	3992
Reduced:	BeN2P2F3C8O9H11 (1)
Stoich.:	AB2C2D3E8F9G11 (1)
Weight, g/mol:	407.001372
ΔH_f, kcal/mol:	-388.86
Dipole, Da:	4.24
IP(EA), eV:	-8.76(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

beryllium;[hydroxy-[2-(3-nitroanilino)ethoxy]phosphoryl] hydrogen phosphate;trifluoride

Drug info:

PubChemData

Smile

[Be+2].C1=CC(=CC(=C1)[N+](=O)[O-])NCCOP(=O)(O)OP(=O)(O)[O-].[F-].[F-].[F-]

DOS

IR

Vibrations