Geometry & MOs

Info

ID:	241057
PubChem CID:	93621466
Reduced:	ON6C15H18 (1)
Stoich.:	AB6C15D18 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	32.26
Dipole, Da:	3.77
IP(EA), eV:	-8.97(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)N[C@H]2CCCN(C2)C3=NC=CC=N3

DOS

IR

Vibrations