Geometry & MOs

Info

ID:	166315
PubChem CID:	74669278
Reduced:	F2N3O3C24H29 (1)
Stoich.:	A2B3C3D24E29 (1)
Weight, g/mol:	345.217818
ΔH_f, kcal/mol:	-163.02
Dipole, Da:	4.42
IP(EA), eV:	-8.57(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[(2,5-dimethoxyphenyl)methylamino]-1-(4-methoxyphenyl)ethyl]-dimethylazanium

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=CC(=O)NCCN2CCN(CC2)CC3=CC=CC=C3)OC(F)F

DOS

IR

Vibrations