Geometry & MOs

Info

ID:	38313
PubChem CID:	8030120
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	311.092436
ΔH_f, kcal/mol:	-135.1
Dipole, Da:	6.5
IP(EA), eV:	-9.56(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4-ethyl-7-hydroxy-8-[(2-methoxyethylamino)methyl]chromen-2-one

Drug info:

PubChemData

Smile

CN1C(=CC(=O)N(C1=O)C)CNC(=O)C2=CC=C(C=C2)OC

DOS

IR

Vibrations