Geometry & MOs

Info

ID:	407829
PubChem CID:	135080584
Reduced:	OF3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	215.069477
ΔH_f, kcal/mol:	-169.11
Dipole, Da:	3.85
IP(EA), eV:	-9.83(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethenyl-1-hydroxy-5-methoxypyrrolo[3,2-b]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)OC(=C)C(F)(F)F

DOS

IR

Vibrations