Geometry & MOs

Info

ID:	313544
PubChem CID:	126615732
Reduced:	FSN2O2C12H17 (1)
Stoich.:	ABC2D2E12F17 (1)
Weight, g/mol:	409.165425
ΔH_f, kcal/mol:	-110.54
Dipole, Da:	5.01
IP(EA), eV:	-9.55(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-(3-acetyl-5-diethoxyphosphorylindol-1-yl)acetate

Drug info:

PubChemData

Smile

C1[C@H](CN[C@@H]1CCNS(=O)(=O)C2=CC=CC=C2)F

DOS

IR

Vibrations