Geometry & MOs

Info

ID:	32188
PubChem CID:	6435801
Reduced:	PN2O5C8H15 (1)
Stoich.:	AB2C5D8E15 (1)
Weight, g/mol:	384.277678
ΔH_f, kcal/mol:	-245.33
Dipole, Da:	4.87
IP(EA), eV:	-9.6(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

trimethyl-[2-[4-[(E)-2-[4-[2-(trimethylazaniumyl)ethoxy]phenyl]ethenyl]phenoxy]ethyl]azanium

Drug info:

PubChemData

Smile

C1CN(C[C@@H](N1)C(=O)O)C/C=C/P(=O)(O)O

DOS

IR

Vibrations