Geometry & MOs

Info

ID:	205060
PubChem CID:	80049540
Reduced:	SN5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	231.148396
ΔH_f, kcal/mol:	96.14
Dipole, Da:	4.07
IP(EA), eV:	-8.64(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N'-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCC(C1=NC=CS1)NC2=NN3C=C(C=CC3=N2)C

DOS

IR

Vibrations