Geometry & MOs

Info

ID:	343321
PubChem CID:	127266494
Reduced:	SF3O4C14H17 (1)
Stoich.:	AB3C4D14E17 (1)
Weight, g/mol:	278.062219
ΔH_f, kcal/mol:	-317.97
Dipole, Da:	7.37
IP(EA), eV:	-9.64(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-(4-fluorophenyl)cyclopropyl]-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)OC(F)(F)F)S(=O)(=O)CC2CCOC2

DOS

IR

Vibrations