Geometry & MOs

Info

ID:	389160
PubChem CID:	134991376
Reduced:	P2O6F12H56C73 (1)
Stoich.:	A2B6C12D56E73 (1)
Weight, g/mol:	182.8199
ΔH_f, kcal/mol:	-684.82
Dipole, Da:	6.5
IP(EA), eV:	-9.39(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CO[C@@]1([C@H]([C@@H]([C@H](O1)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)P(=O)(C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F)P(=O)(C7=CC=CC=C7)C8=CC=CC=C8)COC(C9=CC=CC=C9)(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations