Geometry & MOs

Info

ID:	370233
PubChem CID:	127337900
Reduced:	ON5C19H31 (1)
Stoich.:	AB5C19D31 (1)
Weight, g/mol:	383.212139
ΔH_f, kcal/mol:	-36.09
Dipole, Da:	6.5
IP(EA), eV:	-8.62(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-fluorophenyl)-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations