Geometry & MOs

Info

ID:	58319
PubChem CID:	24697796
Reduced:	NOH7C8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	167.092184
ΔH_f, kcal/mol:	-9.0
Dipole, Da:	4.97
IP(EA), eV:	-9.2(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2,2-trifluoroethyl)cyclopentanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C#N)OC

DOS

IR

Vibrations