Geometry & MOs

Info

ID:	315901
PubChem CID:	126629365
Reduced:	FN2O3C26H27 (1)
Stoich.:	AB2C3D26E27 (1)
Weight, g/mol:	420.184921
ΔH_f, kcal/mol:	-99.67
Dipole, Da:	4.84
IP(EA), eV:	-9.12(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyloxy-N-[(3-fluoro-4-methylphenyl)methyl]-5-[3-(hydroxymethyl)pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNC(=O)C2=C(N=CC(=C2)C3=CC=CC=C3CCO)OCC4CC4)F

DOS

IR

Vibrations