Geometry & MOs

Info

ID:	404888
PubChem CID:	135071664
Reduced:	FN3H10C14 (1)
Stoich.:	AB3C10D14 (1)
Weight, g/mol:	293.01637
ΔH_f, kcal/mol:	86.74
Dipole, Da:	3.58
IP(EA), eV:	-8.96(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-6-methylpyridin-3-yl)-N-methyl-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C=C/C2=CC(=CC=C2)F)N=[N+]=[N-]

DOS

IR

Vibrations