Geometry & MOs

Info

ID:

175763

PubChem CID:

75944725

Reduced:

NSF3O3C18H20 (1)

Stoich.:

ABC3D3E18F20 (1)

Weight, g/mol:

446.067876

ΔHf, kcal/mol:

-250.51

Dipole, Da:

6.65

IP(EA), eV:

-9.04(-0.62)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclopropyl-3-phenylpropanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(C)NS(=O)(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations