Geometry & MOs

Info

ID:	423832
PubChem CID:	135120400
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	380.221226
ΔH_f, kcal/mol:	20.53
Dipole, Da:	3.3
IP(EA), eV:	-9.07(-0.18)
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-(2-methylphenoxy)ethanone

Drug info:

PubChemData

Smile

CN1C(=CC=N1)CN2C[C@H]([C@@H](C2)O)CC3=CC=CC=N3

DOS

IR

Vibrations