Geometry & MOs

Info

ID:	356644
PubChem CID:	127292063
Reduced:	O4N5C19H27 (1)
Stoich.:	A4B5C19D27 (1)
Weight, g/mol:	294.169191
ΔH_f, kcal/mol:	-123.69
Dipole, Da:	5.01
IP(EA), eV:	-8.88(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CN2CCN(CC2)C(=O)CCN3C(=O)C4CCCCC4C3=O

DOS

IR

Vibrations