Geometry & MOs

Info

ID:	370289
PubChem CID:	127337958
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	386.27941
ΔH_f, kcal/mol:	2.82
Dipole, Da:	2.72
IP(EA), eV:	-8.51(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-4-piperidin-1-ylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)N(C)C(=O)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations