Geometry & MOs

Info

ID:	305519
PubChem CID:	124958315
Reduced:	ON6C16H22 (1)
Stoich.:	AB6C16D22 (1)
Weight, g/mol:	337.165108
ΔH_f, kcal/mol:	29.33
Dipole, Da:	8.39
IP(EA), eV:	-9.85(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-[4-(methylamino)pyrazolo[1,5-a]pyrazin-6-yl]piperidin-1-yl]-pyrazin-2-ylmethanone

Drug info:

PubChemData

Smile

CC1=CN=CC(=N1)[C@@H]2CCCN(C2)C(=O)C(C)(C)N3C=NC=N3

DOS

IR

Vibrations