Geometry & MOs

Info

ID:	366836
PubChem CID:	127320424
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-25.79
Dipole, Da:	6.45
IP(EA), eV:	-9.0(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-azatricyclo[4.3.1.13,8]undecan-4-yl)-2-(5-methyl-1,2-oxazol-3-yl)ethanone

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)C(=O)N2CC3CC4CC(C3)CC2C4

DOS

IR

Vibrations