Geometry & MOs

Info

ID:	404404
PubChem CID:	135066169
Reduced:	PO2C30H35 (1)
Stoich.:	AB2C30D35 (1)
Weight, g/mol:	318.064679
ΔH_f, kcal/mol:	-81.46
Dipole, Da:	3.94
IP(EA), eV:	-9.42(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-1H-imidazol-3-ium-2-yl)-[2-[(3-methyl-1H-imidazol-3-ium-2-yl)-oxidophosphoryl]ethyl]phosphinate

Drug info:

PubChemData

Smile

C[C@H]1CC[C@H]([C@@H](C1)OP(=O)(C=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

DOS

IR

Vibrations