Geometry & MOs

Info

ID:	338274
PubChem CID:	127258966
Reduced:	NBr3H4C6 (1)
Stoich.:	AB3C4D6 (1)
Weight, g/mol:	231.042899
ΔH_f, kcal/mol:	27.15
Dipole, Da:	2.5
IP(EA), eV:	-9.91(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl morpholine-2-carboxylate;dihydrochloride

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)Br)Br)Br

DOS

IR

Vibrations