Geometry & MOs

Info

ID:	356530
PubChem CID:	127291677
Reduced:	N3C7H9 (2)
Stoich.:	A3B7C9 (2)
Weight, g/mol:	341.185175
ΔH_f, kcal/mol:	102.45
Dipole, Da:	7.17
IP(EA), eV:	-9.63(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(C=N1)CN2CCN3C(=NN=C3C4CC4)C2

DOS

IR

Vibrations