Geometry & MOs

Info

ID:	362392
PubChem CID:	127307737
Reduced:	ON6C14H18 (1)
Stoich.:	AB6C14D18 (1)
Weight, g/mol:	300.169859
ΔH_f, kcal/mol:	29.16
Dipole, Da:	3.55
IP(EA), eV:	-9.12(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1H-imidazol-5-yl)-[4-[methyl(pyridazin-3-yl)amino]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC=C(N1)C(=O)N2CCC(CC2)NC3=NN=CC=C3

DOS

IR

Vibrations