Geometry & MOs

Info

ID:	367423
PubChem CID:	127324585
Reduced:	O2N6C19H30 (1)
Stoich.:	A2B6C19D30 (1)
Weight, g/mol:	328.201159
ΔH_f, kcal/mol:	-42.79
Dipole, Da:	3.93
IP(EA), eV:	-8.85(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCOC1=NC(=NC(=C1)C)N2CCN(CC2)C(=O)NC3CCN(C3)C4CC4

DOS

IR

Vibrations