Geometry & MOs

Info

ID:	196602
PubChem CID:	78852335
Reduced:	O2F3N4H11C13 (1)
Stoich.:	A2B3C4D11E13 (1)
Weight, g/mol:	291.101919
ΔH_f, kcal/mol:	-168.15
Dipole, Da:	5.14
IP(EA), eV:	-9.73(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(3-fluorophenoxy)propanoyl]-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)NNC(=O)C2=CC=CN2

DOS

IR

Vibrations