Geometry & MOs

Info

ID:	337054
PubChem CID:	127256619
Reduced:	O5H8C9 (1)
Stoich.:	A5B8C9 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-157.17
Dipole, Da:	3.21
IP(EA), eV:	-9.18(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[(decylamino)methylidene]-6-methylpyran-2,4-dione

Drug info:

PubChemData

Smile

C1CC(=O)OC2=CC=COC2OC1=O

DOS

IR

Vibrations