Geometry & MOs

Info

ID:	253798
PubChem CID:	103120701
Reduced:	ON4C15H18 (1)
Stoich.:	AB4C15D18 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	27.51
Dipole, Da:	7.46
IP(EA), eV:	-8.36(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(methylaminomethyl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CC(C3=CC=CC=C32)CCN

DOS

IR

Vibrations