Geometry & MOs

Info

ID:	189781
PubChem CID:	77903583
Reduced:	ClO7C11H15 (1)
Stoich.:	AB7C11D15 (1)
Weight, g/mol:	297.100108
ΔH_f, kcal/mol:	-308.96
Dipole, Da:	3.08
IP(EA), eV:	-10.77(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-2-(4-oxo-2-phenyl-2,3-dihydrochromen-8-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)C(C1C(C(C(O1)Cl)(C(=O)C)O)(C(=O)C)O)O

DOS

IR

Vibrations