Geometry & MOs

Info

ID:

216080

PubChem CID:

85085682

Reduced:

C8H15 (2)

Stoich.:

A8B15 (2)

Weight, g/mol:

226.062139

ΔHf, kcal/mol:

-41.32

Dipole, Da:

0.62

IP(EA), eV:

-9.0(1.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-anilino-6-chloro-1,3,5-triazinan-2-one

Drug info:

PubChemData

Smile

CCCCCCC=CC(=CCCC)CCC

DOS

IR

Vibrations