Geometry & MOs

Info

ID:	176200
PubChem CID:	76008288
Reduced:	NSO4C32H35 (1)
Stoich.:	ABC4D32E35 (1)
Weight, g/mol:	519.266797
ΔH_f, kcal/mol:	-114.22
Dipole, Da:	4.63
IP(EA), eV:	-8.93(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-trimethyl-N-[1-[[6-methyl-1-[3-(propan-2-ylamino)phenyl]indazol-4-yl]amino]propan-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)N(CC5=CC=CC=C5)CC6=CC=CC=C6

DOS

IR

Vibrations