Geometry & MOs

Info

ID:	419617
PubChem CID:	135108552
Reduced:	N2O3C22H26 (1)
Stoich.:	A2B3C22D26 (1)
Weight, g/mol:	375.201888
ΔH_f, kcal/mol:	-87.14
Dipole, Da:	3.82
IP(EA), eV:	-9.02(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3(CCN(CC3)C(=O)[C@H](C4=CC=CC=C4)N)OCC2

DOS

IR

Vibrations