Geometry & MOs

Info

ID:	293925
PubChem CID:	117416483
Reduced:	FCl2O2C11H11 (1)
Stoich.:	AB2C2D11E11 (1)
Weight, g/mol:	265.095023
ΔH_f, kcal/mol:	-147.19
Dipole, Da:	3.19
IP(EA), eV:	-9.85(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2,2-dimethyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

CC(C)(CC1=CC(=C(C=C1Cl)F)Cl)C(=O)O

DOS

IR

Vibrations