Geometry & MOs

Info

ID:	167844
PubChem CID:	74886135
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	258.09642
ΔH_f, kcal/mol:	-150.25
Dipole, Da:	7.59
IP(EA), eV:	-9.14(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dioxo-1,2,4-triazinan-6-yl)-4-methoxypyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(C(=O)O)NC(=O)C=CC1=CC=C(C=C1)OC

DOS

IR

Vibrations