Geometry & MOs

Info

ID:	355692
PubChem CID:	127289673
Reduced:	O3N5C18H29 (1)
Stoich.:	A3B5C18D29 (1)
Weight, g/mol:	387.263425
ΔH_f, kcal/mol:	-73.82
Dipole, Da:	7.67
IP(EA), eV:	-8.65(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2,6-trimethyl-N-[1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidin-4-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N(C)C2CCN(CC2)CC(=O)N3CCN(CC3)C

DOS

IR

Vibrations