Geometry & MOs

Info

ID:	398497
PubChem CID:	135033518
Reduced:	O3S3F6C13H16 (1)
Stoich.:	A3B3C6D13E16 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	-442.4
Dipole, Da:	5.38
IP(EA), eV:	-9.57(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-[(2-methylpropan-2-yl)oxy]-3-phenyl-1H-indol-2-one

Drug info:

PubChemData

Smile

CCOC(=S)SC(CC1CCSC1=O)CC(C(F)(F)F)(C(F)(F)F)O

DOS

IR

Vibrations