Geometry & MOs

Info

ID:	279532
PubChem CID:	103844250
Reduced:	ClSN2O2C12H15 (1)
Stoich.:	ABC2D2E12F15 (1)
Weight, g/mol:	281.113982
ΔH_f, kcal/mol:	-59.21
Dipole, Da:	4.93
IP(EA), eV:	-8.94(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(cyclopenten-1-yl)ethylamino]-6-(trifluoromethyl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

COC(=O)C1=C(N=C(S1)NCCC2=CCCC2)Cl

DOS

IR

Vibrations