Geometry & MOs

Info

ID:	419507
PubChem CID:	135108327
Reduced:	FN2O3C20H27 (1)
Stoich.:	AB2C3D20E27 (1)
Weight, g/mol:	356.167083
ΔH_f, kcal/mol:	-180.82
Dipole, Da:	4.55
IP(EA), eV:	-9.39(0.04)
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]-2-thiophen-2-ylethanone

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)CCCC3=CC=C(C=C3)F)C(=O)O

DOS

IR

Vibrations