Geometry & MOs

Info

ID:	253852
PubChem CID:	103121119
Reduced:	ON5C12H15 (1)
Stoich.:	AB5C12D15 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	26.21
Dipole, Da:	3.39
IP(EA), eV:	-9.04(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(aminomethyl)-4-methylpiperidin-1-yl]-(1-methylindazol-3-yl)methanone

Drug info:

PubChemData

Smile

C1C[C@@H](CNC1)NC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations