Geometry & MOs

Info

ID:

179257

PubChem CID:

76456626

Reduced:

N4O8C17H20 (1)

Stoich.:

A4B8C17D20 (1)

Weight, g/mol:

504.16237

ΔHf, kcal/mol:

-242.33

Dipole, Da:

3.02

IP(EA), eV:

 -10.43(-1.97)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

10-bromo-5-methoxy-13,14,18,18-tetramethyl-20-(methylamino)-2-oxa-6-azapentacyclo[11.8.0.01,17.03,11.04,8]henicosa-3,8,10-triene-7,19-dione

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2C(C(C(O2)CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)O

DOS

IR

Vibrations