Geometry & MOs

Info

ID:	369750
PubChem CID:	127335199
Reduced:	ON4C19H30 (1)
Stoich.:	AB4C19D30 (1)
Weight, g/mol:	370.126361
ΔH_f, kcal/mol:	-44.01
Dipole, Da:	6.66
IP(EA), eV:	-8.72(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)CC(=O)NC2CCCN(C2)C3=NN=C(C=C3)C

DOS

IR

Vibrations