Appendix F. Table of probe names
Table of probe symbols which may be used in order to define
the properties of single-atom probes.
PROBE BRIEF DESCRIPTION PROBE BRIEF DESCRIPTION
NAME NAME
C3 Methyl CH3 group C1= sp2 CH aromatic or vinyl
N:# sp N with lone pair N:= sp2 N with lone pair
N: sp3 N with lone pair N-: Anionic tetrazole N
N1 Neutral flat NH eg amide N1+ sp3 amine NH cation
N1= sp2 Amine NH cation N1: sp3 NH with lone pair
NH= sp2 NH with lone pair N1# sp NH with one hydrogen
N2 Neutral flat NH2 eg amide N2+ sp3 amine NH2 cation
N2= sp2 Amine NH2 cation N2: sp3 NH2 with lone pair
N3+ sp3 amine NH3 cation NM3 trimethyl-ammonium
cation
O1 Alkyl hydroxy OH group OH Phenol or carboxy OH
O- sp2 phenolate oxygen O sp2 carbonyl oxygen
O:: sp2 carboxy oxygen atom COO- Multi-atom carboxy
OES sp3 ester oxygen atom OC2 Ether or furan oxygen
OS O of sulphone / sulphoxide ON Oxygen of nitro group
O= O of sulphate/sulphonamide OH2 Water
PO4 PO4 phosphate dianion PO4H PO4H phosphate anion
S1 Neutral SH group
F Organic fluorine atom F- Fluoride anion
CL Organic chlorine atom CL- Chloride anion
BR Organic bromine atom BR- Bromide anion
I Organic iodine atom I- Iodide anion
LI+ Lithium cation NA+ Sodium cation
K+ Potassium cation RB+ Rubidium cation
CS+ Caesium cation MG+2 Magnesium cation
CA+2 Calcium cation SR+2 Strontium cation
ZN+2 Zinc cation CU+2 Cupric copper cation
FE+2 Ferrous iron cation FE+3 Ferric iron cation
BOTH The Amphipatic Probe DRY The Hydrophobic Probe |