Geometry & MOs

Info

ID:	180737
PubChem CID:	76677475
Reduced:	N2F3O4C18H23 (1)
Stoich.:	A2B3C4D18E23 (1)
Weight, g/mol:	229.131408
ΔH_f, kcal/mol:	-347.37
Dipole, Da:	5.35
IP(EA), eV:	-9.72(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-diethyl-5-methyl-3-oxomorpholin-4-yl)acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCN(C1)C(=O)CC2=CC=C(C=C2)OC(F)(F)F

DOS

IR

Vibrations