Geometry & MOs

Info

ID:

159771

PubChem CID:

57288733

Reduced:

O3C15H28 (1)

Stoich.:

A3B15C28 (1)

Weight, g/mol:

415.091201

ΔHf, kcal/mol:

-178.92

Dipole, Da:

3.18

IP(EA), eV:

-10.1(0.19)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2-phenoxy-1,3-thiazol-5-yl)methyl (1R,3R)-2,2-dimethyl-3-[(2-oxothiolan-3-ylidene)methyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCC(C(CCC)CO)OC(=O)C(=CC)C

DOS

IR

Vibrations