Geometry & MOs

Info

ID:	449846
PubChem CID:	135302069
Reduced:	NO3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	199.157229
ΔH_f, kcal/mol:	-148.91
Dipole, Da:	2.88
IP(EA), eV:	-9.24(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-2,2-dimethylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CCOC[C@@H]1COC

DOS

IR

Vibrations