Geometry & MOs

Info

ID:	369745
PubChem CID:	127335194
Reduced:	O2N5C21H25 (1)
Stoich.:	A2B5C21D25 (1)
Weight, g/mol:	394.24811
ΔH_f, kcal/mol:	-35.0
Dipole, Da:	6.42
IP(EA), eV:	-8.54(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)CN3C(=O)CCC4=CC=CC=C43

DOS

IR

Vibrations