Geometry & MOs

Info

ID:	150060
PubChem CID:	53789745
Reduced:	FN3O3C23H28 (1)
Stoich.:	AB3C3D23E28 (1)
Weight, g/mol:	346.253475
ΔH_f, kcal/mol:	-133.0
Dipole, Da:	5.77
IP(EA), eV:	-8.78(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

dimethyl-(1-naphthalen-1-ylheptan-2-yl)-phenylazanium

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN2C(C=CC3=C2C(=CC(=C3N4CC(N(C(C4)C)C)C)F)C1=O)C

DOS

IR

Vibrations