Geometry & MOs

Info

ID:	279274
PubChem CID:	103842668
Reduced:	BrNOSF2H8C12 (1)
Stoich.:	ABCDE2F8G12 (1)
Weight, g/mol:	313.98663
ΔH_f, kcal/mol:	-81.13
Dipole, Da:	4.34
IP(EA), eV:	-9.29(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2,5-difluorophenyl)-1-methylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

C1=CSC=C1CC(=O)NC2=CC(=C(C=C2F)Br)F

DOS

IR

Vibrations