Geometry & MOs

Info

ID:	362730
PubChem CID:	127309275
Reduced:	O3N5C19H35 (1)
Stoich.:	A3B5C19D35 (1)
Weight, g/mol:	389.290309
ΔH_f, kcal/mol:	-144.98
Dipole, Da:	3.09
IP(EA), eV:	-8.53(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CCC(CC2)NC(=O)N(C)CC(=O)N3CCOCC3

DOS

IR

Vibrations