Geometry & MOs

Info

ID:	199183
PubChem CID:	79210517
Reduced:	ClON2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	234.116841
ΔH_f, kcal/mol:	-24.49
Dipole, Da:	1.84
IP(EA), eV:	-8.84(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-fluoro-5-methylphenyl)cyclopent-2-ene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2CC(C=C2)N)Cl

DOS

IR

Vibrations