Geometry & MOs

Info

ID:

378670

PubChem CID:

134224764

Reduced:

SN2H34C52 (1)

Stoich.:

AB2C34D52 (1)

Weight, g/mol:

353.210327

ΔHf, kcal/mol:

231.84

Dipole, Da:

3.05

IP(EA), eV:

 -7.83(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-ethyl-2-[(Z)-2-methoxypent-2-en-4-ynyl]-6,7,9-trimethyl-5,7,8,9-tetrahydroimidazo[1,2-a]quinoxalin-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C4=C(C=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6)N(C3=C(C7=C2SC8=C7C=CC9=CC=CC=C98)C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations