Geometry & MOs

Info

ID:	264805
PubChem CID:	103491150
Reduced:	NO4C8H13 (1)
Stoich.:	AB4C8D13 (1)
Weight, g/mol:	298.080101
ΔH_f, kcal/mol:	-165.79
Dipole, Da:	4.89
IP(EA), eV:	-10.14(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-3-[(2-methoxy-6-nitrobenzoyl)amino]propanoate

Drug info:

PubChemData

Smile

COC(=O)C(CNC(=O)CC=C)O

DOS

IR

Vibrations