Geometry & MOs

Info

ID:	162077
PubChem CID:	57393531
Reduced:	SF3N3O4C26H32 (1)
Stoich.:	AB3C3D4E26F32 (1)
Weight, g/mol:	584.034241
ΔH_f, kcal/mol:	-309.76
Dipole, Da:	5.84
IP(EA), eV:	-8.92(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[4-(tert-butylcarbamoyl)-2-[(2,4-dichlorophenyl)sulfonylamino]phenoxy]-3-chlorophenyl]acetic acid

Drug info:

PubChemData

Smile

CC(C)N[C@@H]1CC[C@@H](C[C@H]1CS(=O)(=O)C2=CC=CC=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations