Geometry & MOs

Info

ID:	32055
PubChem CID:	4254409
Reduced:	SF2O4N5H19C25 (1)
Stoich.:	AB2C4D5E19F25 (1)
Weight, g/mol:	478.076947
ΔH_f, kcal/mol:	-110.73
Dipole, Da:	4.64
IP(EA), eV:	-8.85(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-2-[[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C3=NN=C(S3)NC(=O)C(CC4=CC=CC=C4)NC(=O)NC5=CC(=C(C=C5)F)F

DOS

IR

Vibrations