Geometry & MOs

Info

ID:	206517
PubChem CID:	80263877
Reduced:	ON4C12H12 (1)
Stoich.:	AB4C12D12 (1)
Weight, g/mol:	250.148141
ΔH_f, kcal/mol:	18.28
Dipole, Da:	2.31
IP(EA), eV:	-8.76(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(aminomethyl)cyclopentyl]-2-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NC2=NC=CC=N2)N

DOS

IR

Vibrations