Geometry & MOs

Info

ID:	439
PubChem CID:	2769
Reduced:	ClFN3O4C23H29 (1)
Stoich.:	ABC3D4E23F29 (1)
Weight, g/mol:	465.183062
ΔH_f, kcal/mol:	-180.83
Dipole, Da:	6.61
IP(EA), eV:	-8.72(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-chloro-N-[1-[3-(4-fluorophenoxy)propyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide

Drug info:

PubChemData

Smile

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCOC3=CC=C(C=C3)F

DOS

IR

Vibrations