Geometry & MOs

Info

ID:	136517
PubChem CID:	52055671
Reduced:	ON6C24H34 (1)
Stoich.:	AB6C24D34 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	21.17
Dipole, Da:	2.77
IP(EA), eV:	-8.27(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethoxyethyl)-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCNC(=O)C2CCN(CC2)C3=NN=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations