Geometry & MOs

Info

ID:	305521
PubChem CID:	124958332
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	440.222369
ΔH_f, kcal/mol:	38.91
Dipole, Da:	2.19
IP(EA), eV:	-9.25(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4,6-dimethyl-2-[(3R)-1-[(2R)-oxolane-2-carbonyl]piperidin-3-yl]pyrimidin-5-yl]-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC[C@H](CC1)CC2=CC(=CN=C2)C3=CN=C4N3C=CC=N4

DOS

IR

Vibrations