Geometry & MOs

Info

ID:	443366
PubChem CID:	135258742
Reduced:	ON4H26C28 (1)
Stoich.:	AB4C26D28 (1)
Weight, g/mol:	423.242296
ΔH_f, kcal/mol:	106.13
Dipole, Da:	6.46
IP(EA), eV:	-8.82(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4,5-diphenyl-1H-imidazol-2-yl)methyl]-4-[(3-methylpyridin-2-yl)methyl]piperazine

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC(=CC=C2)C#N)CC3=NC(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations