Geometry & MOs

Info

ID:

256357

PubChem CID:

103138727

Reduced:

NOC12H23 (1)

Stoich.:

ABC12D23 (1)

Weight, g/mol:

208.157563

ΔHf, kcal/mol:

-55.6

Dipole, Da:

2.96

IP(EA), eV:

-8.76(2.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-cyclopentyl-1-(1-methylpyrazol-3-yl)propan-1-ol

Drug info:

PubChemData

Smile

CCNCC1(CC1)CC2CCC(O2)C

DOS

IR

Vibrations