Geometry & MOs

Info

ID:	74883
PubChem CID:	48422641
Reduced:	SF2N2O4C17H22 (1)
Stoich.:	AB2C2D4E17F22 (1)
Weight, g/mol:	347.184506
ΔH_f, kcal/mol:	-223.53
Dipole, Da:	3.14
IP(EA), eV:	-9.23(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(1-acetylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)F)OCC3CC3

DOS

IR

Vibrations