Geometry & MOs

Info

ID:	346516
PubChem CID:	127271020
Reduced:	ON5C20H25 (1)
Stoich.:	AB5C20D25 (1)
Weight, g/mol:	291.133139
ΔH_f, kcal/mol:	8.47
Dipole, Da:	6.47
IP(EA), eV:	-8.74(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-(5-methyl-1,3-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)NC3CCC4=NC(=CN4C3)C(C)(C)C)NN=C2

DOS

IR

Vibrations