Geometry & MOs

Info

ID:	366654
PubChem CID:	127320183
Reduced:	SO2N6C18H22 (1)
Stoich.:	AB2C6D18E22 (1)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	13.9
Dipole, Da:	2.01
IP(EA), eV:	-8.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CN2CCN(CC2)CC3=NC4=C(C5=C(S4)CCC5)C(=O)N3

DOS

IR

Vibrations