Geometry & MOs

Info

ID:	442283
PubChem CID:	135251001
Reduced:	O2H22C27 (1)
Stoich.:	A2B22C27 (1)
Weight, g/mol:	270.184447
ΔH_f, kcal/mol:	18.14
Dipole, Da:	1.3
IP(EA), eV:	-8.78(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1E,3Z)-2-[piperazin-1-yl(pyridin-3-yl)methyl]penta-1,3-dienyl]methanimine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=C(C=C5)OCCO

DOS

IR

Vibrations