Geometry & MOs

Info

ID:	136515
PubChem CID:	52054525
Reduced:	ON3C14H19 (2)
Stoich.:	AB3C14D19 (2)
Weight, g/mol:	406.236876
ΔH_f, kcal/mol:	-32.71
Dipole, Da:	8.76
IP(EA), eV:	-7.98(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(4-ethoxyphenyl)pyridazin-3-yl]-N,N-bis(prop-2-enyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCC(CC3)C(=O)N4CCN(CC4)CC(=O)N5CCCCC5

DOS

IR

Vibrations