Geometry & MOs

Info

ID:	443639
PubChem CID:	135259627
Reduced:	SO3H16C21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	410.184172
ΔH_f, kcal/mol:	-43.42
Dipole, Da:	8.72
IP(EA), eV:	-9.11(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-methoxy-N-methyl-3-(2-morpholin-4-ylethoxy)anilino]chromen-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC=C(S2)C3=CC(=O)OC4=C3C=CC(=C4)OC

DOS

IR

Vibrations