Geometry & MOs

Info

ID:	324254
PubChem CID:	126677244
Reduced:	O2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	275.064116
ΔH_f, kcal/mol:	-45.78
Dipole, Da:	5.6
IP(EA), eV:	-8.6(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[(E)-4-methoxy-4-oxobut-2-enoyl]peroxy-5-oxopentanoic acid

Drug info:

PubChemData

Smile

COC1CCN(C[C@H]1O)C2=CC=NN2

DOS

IR

Vibrations