Geometry & MOs

Info

ID:	267939
PubChem CID:	103590513
Reduced:	FN4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	238.148141
ΔH_f, kcal/mol:	1.67
Dipole, Da:	3.13
IP(EA), eV:	-8.36(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-4-fluoro-5-methylanilino)methyl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NCC2=CN=CN2

DOS

IR

Vibrations