Geometry & MOs

Info

ID:	361372
PubChem CID:	127303238
Reduced:	ON6C17H24 (1)
Stoich.:	AB6C17D24 (1)
Weight, g/mol:	308.138559
ΔH_f, kcal/mol:	38.96
Dipole, Da:	2.26
IP(EA), eV:	-8.96(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C(C)C(=O)N2CCN3C(=NN=C3C4CC4)C2

DOS

IR

Vibrations