Geometry & MOs

Info

ID:	160786
PubChem CID:	57389781
Reduced:	O3N6C25H34 (1)
Stoich.:	A3B6C25D34 (1)
Weight, g/mol:	423.22704
ΔH_f, kcal/mol:	-82.88
Dipole, Da:	6.1
IP(EA), eV:	-8.48(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1'-methylspiro[2H-indole-3,4'-piperidine]-1-yl)-2-oxoethyl]-6-morpholin-4-yl-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=C3CCN(C3=CC=C2)C(=O)CC4=NC(=CC(=O)N4C)N5CCOCC5

DOS

IR

Vibrations