Geometry & MOs

Info

ID:	420723
PubChem CID:	135114707
Reduced:	SN3O6C14H21 (1)
Stoich.:	AB3C6D14E21 (1)
Weight, g/mol:	351.20591
ΔH_f, kcal/mol:	-205.49
Dipole, Da:	7.99
IP(EA), eV:	-8.66(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-6-(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@@H]1NC(=O)C2=CC(=O)C(=CN2)OC

DOS

IR

Vibrations