Geometry & MOs

Info

ID:	353527
PubChem CID:	127285104
Reduced:	N3O3C18H31 (1)
Stoich.:	A3B3C18D31 (1)
Weight, g/mol:	389.24269
ΔH_f, kcal/mol:	-137.6
Dipole, Da:	5.08
IP(EA), eV:	-8.78(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-morpholin-4-ylbutan-2-yl)-3-(1,3,4-trimethyl-6-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)propanamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)C2CCCN(C2)C(=O)C3CC3

DOS

IR

Vibrations