Geometry & MOs

Info

ID:	130832
PubChem CID:	51115773
Reduced:	ClFN2O2H16C20 (1)
Stoich.:	ABC2D2E16F20 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-52.52
Dipole, Da:	4.46
IP(EA), eV:	-9.17(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-acetamido-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]hexanamide

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)COC2=CC=CC(=C2)CNC(=O)C3=C(C=CC=C3Cl)F

DOS

IR

Vibrations