Geometry & MOs

Info

ID:	169871
PubChem CID:	75159696
Reduced:	N2O3C28H32 (1)
Stoich.:	A2B3C28D32 (1)
Weight, g/mol:	307.158372
ΔH_f, kcal/mol:	-43.62
Dipole, Da:	4.38
IP(EA), eV:	-9.24(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[4-[(4-fluorophenyl)methyl]piperidin-1-yl]-1-oxopropan-2-yl] acetate

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC=C(C=C2)C3=CC(=NO3)C(=O)NC4CCCC4OCC5=CC=CC=C5

DOS

IR

Vibrations