Geometry & MOs

Info

ID:	172039
PubChem CID:	75457901
Reduced:	ClF2O2N5H20C21 (1)
Stoich.:	AB2C2D5E20F21 (1)
Weight, g/mol:	379.063604
ΔH_f, kcal/mol:	-108.2
Dipole, Da:	5.9
IP(EA), eV:	-8.84(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC=C(C=C2)Cl)C(=O)NC3=C4C=CC=NC4=C(C=C3)OC(F)F

DOS

IR

Vibrations