Geometry & MOs

Info

ID:	414603
PubChem CID:	135087562
Reduced:	SN3O4C13H19 (1)
Stoich.:	AB3C4D13E19 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-131.47
Dipole, Da:	2.71
IP(EA), eV:	-9.75(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-aminospiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)-(3,4-dimethoxyphenyl)methanone

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)C2=CC=CC=N2

DOS

IR

Vibrations