Geometry & MOs

Info

ID:	271120
PubChem CID:	103643975
Reduced:	FION3H11C12 (1)
Stoich.:	ABCD3E11F12 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-9.04
Dipole, Da:	4.58
IP(EA), eV:	-9.16(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydroxy-5-methoxyphenyl)-(3-methoxypiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CCC1=CC(=NN1)NC(=O)C2=C(C=C(C=C2)F)I

DOS

IR

Vibrations