Geometry & MOs

Info

ID:	426987
PubChem CID:	135154873
Reduced:	O3N7C21H25 (1)
Stoich.:	A3B7C21D25 (1)
Weight, g/mol:	437.217538
ΔH_f, kcal/mol:	-4.11
Dipole, Da:	6.45
IP(EA), eV:	-8.87(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN=C1N2CCC(CC2)OC3=CN=C(C=C3)OC)C(=O)NCC4=CC=NN4

DOS

IR

Vibrations