Geometry & MOs

Info

ID:	175746
PubChem CID:	75943000
Reduced:	N2F3O4C21H29 (1)
Stoich.:	A2B3C4D21E29 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-335.19
Dipole, Da:	4.62
IP(EA), eV:	-8.92(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-morpholin-4-ylbenzoyl)piperidin-3-yl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)C(=O)CCC2=CC(=C(C=C2)OCC(F)(F)F)OC

DOS

IR

Vibrations