Geometry & MOs

Info

ID:	231299
PubChem CID:	87573419
Reduced:	O4F7C12H15 (1)
Stoich.:	A4B7C12D15 (1)
Weight, g/mol:	285.016726
ΔH_f, kcal/mol:	-527.38
Dipole, Da:	2.87
IP(EA), eV:	-10.44(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-hydroxy-1-phosphono-3-(1H-pyrrol-3-yl)propyl]phosphonic acid

Drug info:

PubChemData

Smile

CC(C=C(C)C(=O)O)OCCOCC(C(C(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations