Geometry & MOs

Info

ID:

430070

PubChem CID:

135170127

Reduced:

ON4H24C25 (1)

Stoich.:

AB4C24D25 (1)

Weight, g/mol:

235.157229

ΔHf, kcal/mol:

162.36

Dipole, Da:

6.09

IP(EA), eV:

-8.55(-1.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide

Drug info:

PubChemData

Smile

CN1C2CC3C24CC(C3)CC(C4)C15C=NC6=C(O5)C7=C(C8=C6C=CC=N8)N=CC=C7

DOS

IR

Vibrations