Geometry & MOs

Info

ID:	444603
PubChem CID:	135263010
Reduced:	NO4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	287.062757
ΔH_f, kcal/mol:	-152.48
Dipole, Da:	6.24
IP(EA), eV:	-9.19(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(1,1-dioxo-1,4-thiazinan-4-yl)-2-fluorophenyl]acetic acid

Drug info:

PubChemData

Smile

CC1(C2=C(C=CC(=C2)CC(=O)O)N(C1=O)C)O

DOS

IR

Vibrations