Geometry & MOs

Info

ID:

201671

PubChem CID:

79567291

Reduced:

N2O2C9H14 (1)

Stoich.:

A2B2C9D14 (1)

Weight, g/mol:

154.074228

ΔHf, kcal/mol:

-51.25

Dipole, Da:

2.79

IP(EA), eV:

-9.62(-0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-methoxy-1-(1-methylpyrazol-3-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)OCC(=O)C1=CN(N=C1)C

DOS

IR

Vibrations