Geometry & MOs

Info

ID:	60389
PubChem CID:	26683984
Reduced:	NO6C22H23 (1)
Stoich.:	AB6C22D23 (1)
Weight, g/mol:	386.256943
ΔH_f, kcal/mol:	-211.2
Dipole, Da:	2.49
IP(EA), eV:	-8.43(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl-(1-ethylpiperidin-1-ium-4-yl)azanium

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)C(=O)OCC

DOS

IR

Vibrations