Geometry & MOs

Info

ID:	426685
PubChem CID:	135153340
Reduced:	ClO2N3S3F4H6C11 (1)
Stoich.:	AB2C3D3E4F6G11 (1)
Weight, g/mol:	388.948273
ΔH_f, kcal/mol:	-177.6
Dipole, Da:	2.06
IP(EA), eV:	-9.55(-2.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-4-(trifluoromethoxy)phenyl]-4-(difluoromethyl)thiadiazole-5-carbothioamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1S(=O)(=O)C(F)F)Cl)NC(=S)C2=C(N=NS2)C(F)F

DOS

IR

Vibrations