Geometry & MOs

Info

ID:	49635
PubChem CID:	11533423
Reduced:	ClSN2O5C25H25 (1)
Stoich.:	ABC2D5E25F25 (1)
Weight, g/mol:	501.058181
ΔH_f, kcal/mol:	-160.96
Dipole, Da:	4.93
IP(EA), eV:	-9.1(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2,4-difluorophenyl)methyl]-3-oxo-2H-indazol-5-yl]-4-fluoro-3-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN(C1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

DOS

IR

Vibrations