Geometry & MOs

Info

ID:	305764
PubChem CID:	124968543
Reduced:	ON2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	345.18009
ΔH_f, kcal/mol:	-55.22
Dipole, Da:	6.57
IP(EA), eV:	-8.97(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(3R)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperidin-3-yl]-1H-pyrimidin-2-one

Drug info:

PubChemData

Smile

C[C@@H]1COC(=O)N1C2=NC=NC(=C2)CC3CCNCC3

DOS

IR

Vibrations