Geometry & MOs

Info

ID:	418473
PubChem CID:	135105083
Reduced:	OSN3C12H21 (1)
Stoich.:	ABC3D12E21 (1)
Weight, g/mol:	353.210327
ΔH_f, kcal/mol:	-43.38
Dipole, Da:	1.89
IP(EA), eV:	-9.02(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-[(2,3-dimethoxyphenyl)methyl]-2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]

Drug info:

PubChemData

Smile

CCCC(C1=NC=CN1C)NC(=O)CSCC

DOS

IR

Vibrations