Geometry & MOs

Info

ID:	275962
PubChem CID:	103819491
Reduced:	BrOCl2N2H7C12 (1)
Stoich.:	ABC2D2E7F12 (1)
Weight, g/mol:	279.00072
ΔH_f, kcal/mol:	-6.62
Dipole, Da:	2.41
IP(EA), eV:	-9.37(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopyridin-3-yl)-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)Br)NC(=O)C2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations