Geometry & MOs

Info

ID:	355738
PubChem CID:	127289830
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	383.19574
ΔH_f, kcal/mol:	-28.69
Dipole, Da:	4.03
IP(EA), eV:	-8.62(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCN(CC2)CC(=O)NCCC3CCCCC3

DOS

IR

Vibrations