Geometry & MOs

Info

ID:	406166
PubChem CID:	135076736
Reduced:	P3O17C47H57 (1)
Stoich.:	A3B17C47D57 (1)
Weight, g/mol:	323.074448
ΔH_f, kcal/mol:	-773.0
Dipole, Da:	8.01
IP(EA), eV:	-9.3(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-trimethylsilylethyl 5-chloro-3-formylindole-1-carboxylate

Drug info:

PubChemData

Smile

COCOC1[C@H](C(C([C@@H](C1OCOC)OP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)OP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCOC)OP(=O)OCC6=CC=CC=C6

DOS

IR

Vibrations