Geometry & MOs

Info

ID:	164352
PubChem CID:	74386807
Reduced:	N2O3F4C26H28 (1)
Stoich.:	A2B3C4D26E28 (1)
Weight, g/mol:	220.000572
ΔH_f, kcal/mol:	-277.78
Dipole, Da:	5.7
IP(EA), eV:	-8.45(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-10-oxa-4-thiatricyclo[5.2.1.02,6]decane-3,5-dione

Drug info:

PubChemData

Smile

CC1N(C=CN1CC2=C(C=C(C=C2)F)F)CCOC(=O)C(C3CCC(C3)(F)F)(C4=CC=CC=C4)O

DOS

IR

Vibrations