Geometry & MOs

Info

ID:	260667
PubChem CID:	103199384
Reduced:	NF3O4H8C11 (1)
Stoich.:	AB3C4D8E11 (1)
Weight, g/mol:	334.98977
ΔH_f, kcal/mol:	-266.1
Dipole, Da:	8.84
IP(EA), eV:	-9.68(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)C2=NC(=C(O2)C(=O)O)C(F)(F)F

DOS

IR

Vibrations