Geometry & MOs

Info

ID:	417900
PubChem CID:	135103035
Reduced:	N2O3C19H32 (1)
Stoich.:	A2B3C19D32 (1)
Weight, g/mol:	366.172562
ΔH_f, kcal/mol:	-177.49
Dipole, Da:	1.98
IP(EA), eV:	-9.17(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(dimethylamino)spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl]-3-methylsulfonylpropan-1-one

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)CCC(=O)N2CCC[C@]3(C2)CCC[C@H]3O

DOS

IR

Vibrations