Geometry & MOs

Info

ID:	271023
PubChem CID:	103640488
Reduced:	O2N3C10H15 (1)
Stoich.:	A2B3C10D15 (1)
Weight, g/mol:	209.116427
ΔH_f, kcal/mol:	-52.54
Dipole, Da:	7.38
IP(EA), eV:	-9.23(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxypiperidin-1-yl)-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CCCC(C2)O

DOS

IR

Vibrations