Geometry & MOs

Info

ID:	424251
PubChem CID:	135121897
Reduced:	ClNF2O4H10C16 (1)
Stoich.:	ABC2D4E10F16 (1)
Weight, g/mol:	287.169274
ΔH_f, kcal/mol:	-149.55
Dipole, Da:	5.13
IP(EA), eV:	-9.17(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indol-1-yl]ethanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1F)C(=O)C2=CC3=CC(=NC=C3O2)Cl)F)OC

DOS

IR

Vibrations