Geometry & MOs

Info

ID:	202009
PubChem CID:	79618628
Reduced:	NOC14H25 (1)
Stoich.:	ABC14D25 (1)
Weight, g/mol:	263.210996
ΔH_f, kcal/mol:	-73.5
Dipole, Da:	3.98
IP(EA), eV:	-8.64(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-propylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CN(CC1CCCCC1)C2CCCC(=O)C2

DOS

IR

Vibrations