Geometry & MOs

Info

ID:	274060
PubChem CID:	103806771
Reduced:	OSBr2N2C12H16 (1)
Stoich.:	ABC2D2E12F16 (1)
Weight, g/mol:	210.173213
ΔH_f, kcal/mol:	-14.32
Dipole, Da:	3.82
IP(EA), eV:	-9.05(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-1-[4-(methylamino)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CC(CNC1)CCNC(=O)C2=C(SC(=C2)Br)Br

DOS

IR

Vibrations