Geometry & MOs

Info

ID:	261611
PubChem CID:	103242200
Reduced:	NO4C9H15 (1)
Stoich.:	AB4C9D15 (1)
Weight, g/mol:	269.126323
ΔH_f, kcal/mol:	-155.47
Dipole, Da:	6.26
IP(EA), eV:	-9.46(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[1-(1,4-dioxan-2-ylmethylamino)ethyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

C1COC(CO1)CNC/C=C/C(=O)O

DOS

IR

Vibrations