Geometry & MOs

Info

ID:	170636
PubChem CID:	75262022
Reduced:	O4N5C22H23 (1)
Stoich.:	A4B5C22D23 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-26.37
Dipole, Da:	3.49
IP(EA), eV:	-8.76(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-5-methyl-N-[5-methyl-2-(pyridin-4-ylmethyl)pyrazol-3-yl]-2-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C2=CC=CC=C2OC)NC(=O)C3CC(NN3)C4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations