Geometry & MOs

Info

ID:	144782
PubChem CID:	53412670
Reduced:	ClN2H7C8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	185.058912
ΔH_f, kcal/mol:	34.3
Dipole, Da:	3.83
IP(EA), eV:	-8.73(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-formyl-4-methylpyrrolo[2,3-b]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NC=CC2=C1NC=C2Cl

DOS

IR

Vibrations