Geometry & MOs

Info

ID:	422706
PubChem CID:	135118279
Reduced:	ClON4C13H23 (1)
Stoich.:	ABC4D13E23 (1)
Weight, g/mol:	361.19026
ΔH_f, kcal/mol:	-9.4
Dipole, Da:	4.61
IP(EA), eV:	-8.74(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[(2-phenylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(CN(C)CCN1C=C(C=N1)Cl)N2CCOCC2

DOS

IR

Vibrations