Geometry & MOs

Info

ID:

430401

PubChem CID:

135170465

Reduced:

ClN2C9H15 (1)

Stoich.:

AB2C9D15 (1)

Weight, g/mol:

170.121927

ΔHf, kcal/mol:

1.25

Dipole, Da:

0.74

IP(EA), eV:

-9.17(0.63)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-(1-fluoro-2-methylpropan-2-yl)-1,3-dimethylpyrazole

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)C(C)(C)CCl)C

DOS

IR

Vibrations