Geometry & MOs

Info

ID:	275047
PubChem CID:	103813423
Reduced:	ON4C16H24 (1)
Stoich.:	AB4C16D24 (1)
Weight, g/mol:	261.15896
ΔH_f, kcal/mol:	-26.58
Dipole, Da:	4.29
IP(EA), eV:	-7.88(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)pentanamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC=C(C=C2)NC(=O)[C@@H]3CCCCN3

DOS

IR

Vibrations