Geometry & MOs

Info

ID:	305962
PubChem CID:	124976189
Reduced:	O3N6C24H28 (1)
Stoich.:	A3B6C24D28 (1)
Weight, g/mol:	361.179027
ΔH_f, kcal/mol:	-14.79
Dipole, Da:	3.29
IP(EA), eV:	-8.84(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-(5-benzyl-1,3-oxazol-2-yl)-3-methylpiperidin-1-yl]-pyridin-4-ylmethanone

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)OC)CC(=O)N2CCO[C@@H](C2)C3=NC=C(C=C3)NC4=NC=CC=N4

DOS

IR

Vibrations