Geometry & MOs

Info

ID:	354521
PubChem CID:	127287135
Reduced:	ON6C17H30 (1)
Stoich.:	AB6C17D30 (1)
Weight, g/mol:	318.216809
ΔH_f, kcal/mol:	-30.61
Dipole, Da:	4.52
IP(EA), eV:	-8.68(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN2CC(CCC2=N1)NC(=O)NCC3CCCN(C3)C(C)C

DOS

IR

Vibrations