Geometry & MOs

Info

ID:	419011
PubChem CID:	135107316
Reduced:	FN2O3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	359.17461
ΔH_f, kcal/mol:	-169.49
Dipole, Da:	6.35
IP(EA), eV:	-8.64(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)-quinoxalin-2-ylmethanone

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@H]1C(=O)O)O)C2CCN(CC2)C3=CC(=CC=C3)F

DOS

IR

Vibrations