Geometry & MOs

Info

ID:

433535

PubChem CID:

135173674

Reduced:

INS3O4C7H14 (1)

Stoich.:

ABC3D4E7F14 (1)

Weight, g/mol:

142.020084

ΔHf, kcal/mol:

-154.0

Dipole, Da:

10.11

IP(EA), eV:

-7.91(-1.32)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-methyl-4-(nitrosomethyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CS(=O)(=O)OCC1CCS(=NSI)(=O)CC1

DOS

IR

Vibrations