Geometry & MOs

Info

ID:	207593
PubChem CID:	80422767
Reduced:	BrN2O3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	257.173942
ΔH_f, kcal/mol:	-89.87
Dipole, Da:	3.89
IP(EA), eV:	-9.35(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-2-morpholin-3-ylacetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(O1)Br)C(=O)CC2COCCN2

DOS

IR

Vibrations