Geometry & MOs

Info

ID:	324249
PubChem CID:	126677232
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	195.137162
ΔH_f, kcal/mol:	8.42
Dipole, Da:	3.4
IP(EA), eV:	-8.12(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,6S)-6-methyl-1-(1-methylpyrazol-3-yl)piperidin-3-ol

Drug info:

PubChemData

Smile

C1CCN(C[C@H](C1)O)C2=NN(C=C2)CC3=CC=CC=C3

DOS

IR

Vibrations