Geometry & MOs

Info

ID:	411611
PubChem CID:	135084443
Reduced:	LiN2H5C7 (1)
Stoich.:	AB2C5D7 (1)
Weight, g/mol:	222.092376
ΔH_f, kcal/mol:	30.76
Dipole, Da:	5.74
IP(EA), eV:	-7.89(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-6-chloro-4-methylpyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

[Li+].C1=CC2=C([N-]C=C2)N=C1

DOS

IR

Vibrations