Geometry & MOs

Info

ID:	378679
PubChem CID:	134224773
Reduced:	NC13H25 (1)
Stoich.:	AB13C25 (1)
Weight, g/mol:	158.057909
ΔH_f, kcal/mol:	-18.49
Dipole, Da:	1.67
IP(EA), eV:	-8.58(2.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-6-methyl-1,4-dioxane-2,3-dione

Drug info:

PubChemData

Smile

CCC(CC)C1CCN(CC1)C2CC2

DOS

IR

Vibrations