Geometry & MOs

Info

ID:	279537
PubChem CID:	103844265
Reduced:	ClO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	256.118733
ΔH_f, kcal/mol:	-54.72
Dipole, Da:	5.54
IP(EA), eV:	-8.92(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopenten-1-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

COCCN1C(=O)C(=C(C=N1)NCCC2=CCCC2)Cl

DOS

IR

Vibrations