Geometry & MOs

Info

ID:	255378
PubChem CID:	103131668
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	193.157898
ΔH_f, kcal/mol:	-11.85
Dipole, Da:	3.06
IP(EA), eV:	-8.17(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-[(1-methylpyrazol-3-yl)methyl]piperidine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=CC(=C(C=C2CN)OC)OC

DOS

IR

Vibrations