Geometry & MOs

Info

ID:

255422

PubChem CID:

103131927

Reduced:

O2C11H20 (1)

Stoich.:

A2B11C20 (1)

Weight, g/mol:

194.141913

ΔHf, kcal/mol:

-129.92

Dipole, Da:

2.86

IP(EA), eV:

-9.57(2.31)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2CCC(C2)O

DOS

IR

Vibrations