Geometry & MOs

Info

ID:	426739
PubChem CID:	135153641
Reduced:	SO3N4F5H5C11 (1)
Stoich.:	AB3C4D5E5F11 (1)
Weight, g/mol:	306.979395
ΔH_f, kcal/mol:	-216.5
Dipole, Da:	7.37
IP(EA), eV:	-10.37(-2.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2-fluorophenyl)-4-(difluoromethyl)thiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=C(N=NS2)C(F)F)C(F)(F)F)[N+](=O)[O-]

DOS

IR

Vibrations