Geometry & MOs

Info

ID:

171677

PubChem CID:

75412925

Reduced:

ClSN3O4H10C15 (1)

Stoich.:

ABC3D4E10F15 (1)

Weight, g/mol:

226.168128

ΔHf, kcal/mol:

-6.51

Dipole, Da:

5.43

IP(EA), eV:

-9.87(-2.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-N,4-N-diethylcyclohexane-1,4-dicarboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1S(=O)(=O)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations