Geometry & MOs

Info

ID:	366882
PubChem CID:	127321784
Reduced:	O2N7C15H19 (1)
Stoich.:	A2B7C15D19 (1)
Weight, g/mol:	350.152495
ΔH_f, kcal/mol:	23.9
Dipole, Da:	9.33
IP(EA), eV:	-8.33(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dimethyl-2H-pyrazolo[3,4-c]pyrazol-4-yl)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=NN=C3C2=C(NN3C)C

DOS

IR

Vibrations