Geometry & MOs

Info

ID:	267906
PubChem CID:	103590232
Reduced:	FON3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	238.148141
ΔH_f, kcal/mol:	-80.49
Dipole, Da:	4.62
IP(EA), eV:	-8.31(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1-N-(2-methoxycyclopentyl)-5-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NCCC(=O)N(C)C

DOS

IR

Vibrations