Geometry & MOs

Info

ID:	220605
PubChem CID:	85197940
Reduced:	N2O5C17H24 (1)
Stoich.:	A2B5C17D24 (1)
Weight, g/mol:	336.23006
ΔH_f, kcal/mol:	-206.54
Dipole, Da:	6.73
IP(EA), eV:	-9.11(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 5-butylidene-3-methyl-6-propylcyclohex-3-ene-1,1-dicarboxylate

Drug info:

PubChemData

Smile

CC(C(C12OCC(CO1)(CO2)C)NC(=O)OCC3=CC=CC=C3)N

DOS

IR

Vibrations