Geometry & MOs

Info

ID:	255115
PubChem CID:	103130093
Reduced:	ON3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	-25.59
Dipole, Da:	3.56
IP(EA), eV:	-8.64(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-methylpyrazol-3-yl)-1-propan-2-ylpiperidin-4-ol

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)(C2=NN(C=C2)C)O

DOS

IR

Vibrations