Geometry & MOs

Info

ID:	403741
PubChem CID:	135061643
Reduced:	FN2H12C14 (2)
Stoich.:	AB2C12D14 (2)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	24.3
Dipole, Da:	5.05
IP(EA), eV:	-8.02(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-formyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=CN=C2N1)NC3=C(C=C(C=C3F)N(CC4=CC=CC=C4)CC5=CC=CC=C5)F

DOS

IR

Vibrations