Geometry & MOs

Info

ID:	248498
PubChem CID:	103082127
Reduced:	NSO3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	277.108977
ΔH_f, kcal/mol:	-127.02
Dipole, Da:	4.51
IP(EA), eV:	-8.63(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-(3-methoxycyclopentyl)-4-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=CC=CC=C1NC2CCC(C2)OC

DOS

IR

Vibrations