Geometry & MOs

Info

ID:	126803
PubChem CID:	50979571
Reduced:	FON2H13C16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	365.150619
ΔH_f, kcal/mol:	-2.06
Dipole, Da:	3.98
IP(EA), eV:	-8.72(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-(4-chlorophenoxy)piperidine-4-carbonyl]pyrrolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1F)C2=C(N=CN2)C3=CC=CC=C3

DOS

IR

Vibrations