Geometry & MOs

Info

ID:

184537

PubChem CID:

77174257

Reduced:

NO2C19H27 (1)

Stoich.:

AB2C19D27 (1)

Weight, g/mol:

143.02123

ΔHf, kcal/mol:

-86.32

Dipole, Da:

1.37

IP(EA), eV:

-8.39(-0.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2-methyl-1,3-thiazol-5-yl)boronic acid

Drug info:

PubChemData

Smile

CC12CCC3C(C1CC(C2N)O)CC=C4C3(C=CC(=C4)O)C

DOS

IR

Vibrations