Geometry & MOs

Info

ID:

369977

PubChem CID:

127337028

Reduced:

SN3O3C14H25 (1)

Stoich.:

AB3C3D14E25 (1)

Weight, g/mol:

385.157246

ΔHf, kcal/mol:

-128.42

Dipole, Da:

4.0

IP(EA), eV:

-8.45(0.65)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-(2-ethylimidazol-1-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1CC(=O)N2CCN(CC2)C(=O)C)C

DOS

IR

Vibrations