Geometry & MOs

Info

ID:	392636
PubChem CID:	135017430
Reduced:	NO7C21H23 (1)
Stoich.:	AB7C21D23 (1)
Weight, g/mol:	429.178752
ΔH_f, kcal/mol:	-253.81
Dipole, Da:	8.44
IP(EA), eV:	-9.45(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 5-oxo-2-(pentylamino)-4H-pyrano[3,2-c]chromene-3,4-dicarboxylate

Drug info:

PubChemData

Smile

CCCCCNC1=C(C(C2=C(O1)C3=CC=CC=C3OC2=O)C(=O)OC)C(=O)OC

DOS

IR

Vibrations