Geometry & MOs

Info

ID:	354450
PubChem CID:	127286894
Reduced:	FON5C20H26 (1)
Stoich.:	ABC5D20E26 (1)
Weight, g/mol:	399.243439
ΔH_f, kcal/mol:	-42.65
Dipole, Da:	3.97
IP(EA), eV:	-8.92(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-fluoro-4-(2-methylimidazol-1-yl)phenyl]methyl]-2-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=CN1C2=C(C=C(C=C2)CNC(=O)N3CCN4CCCCC4C3)F

DOS

IR

Vibrations