Geometry & MOs

Info

ID:	445790
PubChem CID:	135269570
Reduced:	N4C27H40 (1)
Stoich.:	A4B27C40 (1)
Weight, g/mol:	434.268176
ΔH_f, kcal/mol:	30.17
Dipole, Da:	1.54
IP(EA), eV:	-8.22(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3,5-dimethyl-4-[[2-(1,2,3,6-tetrahydropyridin-4-yl)phenyl]methyl]piperazin-1-yl]methyl]-N-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1CN(CC(N1CC2=CC=CC(=C2)CN3CCN(CC3)C)C)CC4=CC=C(C=C4)C

DOS

IR

Vibrations