Geometry & MOs

Info

ID:	419354
PubChem CID:	135108022
Reduced:	SF3N4O4C13H19 (1)
Stoich.:	AB3C4D4E13F19 (1)
Weight, g/mol:	368.23246
ΔH_f, kcal/mol:	-288.26
Dipole, Da:	6.82
IP(EA), eV:	-9.95(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C(F)(F)F)C(=O)N[C@@H]2COC[C@H]2CS(=O)(=O)N(C)C

DOS

IR

Vibrations