Geometry & MOs

Info

ID:	28918
PubChem CID:	830640
Reduced:	ClN3O4H12C15 (1)
Stoich.:	AB3C4D12E15 (1)
Weight, g/mol:	330.157957
ΔH_f, kcal/mol:	-0.31
Dipole, Da:	3.93
IP(EA), eV:	-8.83(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(diethylamino)-4-morpholin-4-yl-2-oxochromene-3-carbaldehyde

Drug info:

PubChemData

Smile

CC(=O)C(=NNC1=CC=CC=C1Cl)OC2=CC=CC(=C2)[N+](=O)[O-]

DOS

IR

Vibrations