Geometry & MOs

Info

ID:	255385
PubChem CID:	103131703
Reduced:	ON2C10H16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	-27.81
Dipole, Da:	3.93
IP(EA), eV:	-9.2(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylpyrazol-3-yl)cycloheptan-1-ol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2CCCCC2O

DOS

IR

Vibrations