Geometry & MOs

Info

ID:

295556

PubChem CID:

117533964

Reduced:

NOC5H6 (2)

Stoich.:

ABC5D6 (2)

Weight, g/mol:

195.071785

ΔHf, kcal/mol:

-34.46

Dipole, Da:

4.17

IP(EA), eV:

-8.88(-0.2)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 4-ethoxybenzenecarboximidothioate

Drug info:

PubChemData

Smile

CN=C(C1=CC2=C(C=C1)OCCO2)N

DOS

IR

Vibrations