Geometry & MOs

Info

ID:

158388

PubChem CID:

56463552

Reduced:

OSN2F3C18H21 (1)

Stoich.:

ABC2D3E18F21 (1)

Weight, g/mol:

345.187484

ΔHf, kcal/mol:

-176.37

Dipole, Da:

2.8

IP(EA), eV:

-9.4(-0.76)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-methyl-N-[2-(N-methylanilino)propyl]-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CC(C)C)C(=O)N(C)CC2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations