Geometry & MOs

Info

ID:	370253
PubChem CID:	127337920
Reduced:	ON5C19H31 (1)
Stoich.:	AB5C19D31 (1)
Weight, g/mol:	395.212139
ΔH_f, kcal/mol:	-31.0
Dipole, Da:	3.45
IP(EA), eV:	-8.5(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1N(C)C(=O)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations