Geometry & MOs

Info

ID:	255127
PubChem CID:	103130185
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	208.157563
ΔH_f, kcal/mol:	-13.88
Dipole, Da:	4.07
IP(EA), eV:	-9.39(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-1-(1-methylpyrazol-3-yl)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2(CCCC(C2)C3CC3)O

DOS

IR

Vibrations