Geometry & MOs

Info

ID:	264208
PubChem CID:	103441186
Reduced:	ON5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	282.15437
ΔH_f, kcal/mol:	-20.15
Dipole, Da:	6.33
IP(EA), eV:	-9.04(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-2-(2,4-difluorophenyl)ethanone

Drug info:

PubChemData

Smile

CC1CCN(C(C1)CN)C(=O)C2=NNC(=N2)C(C)C

DOS

IR

Vibrations