Geometry & MOs

Info

ID:	44728
PubChem CID:	10505608
Reduced:	NO4C29H39 (1)
Stoich.:	AB4C29D39 (1)
Weight, g/mol:	421.067968
ΔH_f, kcal/mol:	-176.59
Dipole, Da:	2.26
IP(EA), eV:	-9.36(0.23)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2,5-dichlorophenyl)methyl-triphenylphosphanium

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]([C@@H](CC(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)(C)C2=CC=CC=C2)C)C3=CC=CC=C3)N

DOS

IR

Vibrations