Geometry & MOs

Info

ID:	82876
PubChem CID:	49856733
Reduced:	IOPC22H24 (1)
Stoich.:	ABCD22E24 (1)
Weight, g/mol:	358.163407
ΔH_f, kcal/mol:	-11.18
Dipole, Da:	6.19
IP(EA), eV:	-7.72(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-triethylsilyloxybutyl] 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

C[C@@H](CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)O.[I-]

DOS

IR

Vibrations