Geometry & MOs

Info

ID:	369597
PubChem CID:	127334843
Reduced:	O3N6C14H18 (1)
Stoich.:	A3B6C14D18 (1)
Weight, g/mol:	383.243359
ΔH_f, kcal/mol:	-74.53
Dipole, Da:	5.09
IP(EA), eV:	-8.81(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-methylimidazol-2-yl)methyl]-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=NN=CC=C2)CNC(=O)CN3CC(=O)NC3=O

DOS

IR

Vibrations