Geometry & MOs

Info

ID:	449051
PubChem CID:	135295549
Reduced:	FSN2O3C23H25 (1)
Stoich.:	ABC2D3E23F25 (1)
Weight, g/mol:	444.186064
ΔH_f, kcal/mol:	-81.33
Dipole, Da:	4.03
IP(EA), eV:	-8.35(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,6-difluoro-1,2-dihydrocarbazol-9-yl)-3-[4-(methoxymethyl)-N-methylperoxyanilino]propan-2-ol

Drug info:

PubChemData

Smile

CS(=O)(=O)N(CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O)C/C(=C/C=C)/C(=C)F

DOS

IR

Vibrations