Geometry & MOs

Info

ID:	291181
PubChem CID:	111694070
Reduced:	O2N5C21H35 (1)
Stoich.:	A2B5C21D35 (1)
Weight, g/mol:	404.315127
ΔH_f, kcal/mol:	-51.65
Dipole, Da:	5.76
IP(EA), eV:	-8.79(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[[(2,2-diethyl-4-hydroxybutyl)amino]-(ethylamino)methylidene]amino]methyl]-N,N-diethylbenzamide

Drug info:

PubChemData

Smile

CCCCOCCOCCNC(=NCCCC1=NC2=CC=CC=C2N1)NCC

DOS

IR

Vibrations