Geometry & MOs

Info

ID:	279533
PubChem CID:	103844251
Reduced:	F3N3C14H14 (1)
Stoich.:	A3B3C14D14 (1)
Weight, g/mol:	243.148396
ΔH_f, kcal/mol:	-96.5
Dipole, Da:	1.92
IP(EA), eV:	-9.36(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopenten-1-yl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNC2=C(C=CC(=N2)C(F)(F)F)C#N

DOS

IR

Vibrations