Geometry & MOs

Info

ID:

57000

PubChem CID:

22395202

Reduced:

N5O7C14H23 (2)

Stoich.:

A5B7C14D23 (2)

Weight, g/mol:

264.038236

ΔHf, kcal/mol:

-645.93

Dipole, Da:

12.33

IP(EA), eV:

-9.59(-0.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-3-yl) 2-nitrobenzoate

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC(CC(=O)O)C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(CC(=O)O)N

DOS

IR

Vibrations