Geometry & MOs

Info

ID:	351358
PubChem CID:	127280246
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	353.210327
ΔH_f, kcal/mol:	-102.47
Dipole, Da:	4.47
IP(EA), eV:	-8.51(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(1-phenylcyclopentyl)methanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)CSCC(=O)N3CCCCC3

DOS

IR

Vibrations