Geometry & MOs

Info

ID:	38903
PubChem CID:	8138138
Reduced:	NO4C20H23 (1)
Stoich.:	AB4C20D23 (1)
Weight, g/mol:	304.097168
ΔH_f, kcal/mol:	-121.9
Dipole, Da:	3.55
IP(EA), eV:	-8.6(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[2-oxo-2-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OCC(=O)O[C@@H](C2=CC=CC=C2)C(=O)N(C)C)C

DOS

IR

Vibrations