Geometry & MOs

Info

ID:	406091
PubChem CID:	135076470
Reduced:	NSO2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	291.1462
ΔH_f, kcal/mol:	-19.13
Dipole, Da:	2.35
IP(EA), eV:	-8.95(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-trimethylsilylethoxymethyl)indol-2-yl]boronic acid

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](CSCC1=CC=CC=C1)[N+]#[C-]

DOS

IR

Vibrations