Geometry & MOs

Info

ID:

214750

PubChem CID:

85083583

Reduced:

ClSN2O4F6H15C26 (1)

Stoich.:

ABC2D4E6F15G26 (1)

Weight, g/mol:

600.037896

ΔHf, kcal/mol:

-371.05

Dipole, Da:

5.12

IP(EA), eV:

 -8.82(-1.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-chloro-N-[3-(1-methylpyrrolidin-3-yl)oxy-4-(trifluoromethyl)phenyl]-4-[4-(trifluoromethoxy)phenyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C=CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)Cl)C3=CC=C(O3)C4=CSC(=N4)CC(=O)O

DOS

IR

Vibrations