Geometry & MOs

Info

ID:

279644

PubChem CID:

103844559

Reduced:

NO2H15C16 (1)

Stoich.:

AB2C15D16 (1)

Weight, g/mol:

235.0667

ΔHf, kcal/mol:

-12.22

Dipole, Da:

4.37

IP(EA), eV:

-9.0(-0.85)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[4-(1,3-thiazol-2-ylmethoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)COC2=CC=C(C=C2)CCO)C#N

DOS

IR

Vibrations