Geometry & MOs

Info

ID:

339752

PubChem CID:

127261754

Reduced:

N5H11C12 (1)

Stoich.:

A5B11C12 (1)

Weight, g/mol:

290.036128

ΔHf, kcal/mol:

127.34

Dipole, Da:

2.35

IP(EA), eV:

-8.91(-0.98)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-O-cyclohexa-1,3-dien-1-yl 2-O-imidazo[2,1-b][1,3]thiazol-6-yl oxalate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NNC2=NN3C=CN=C3C=C2

DOS

IR

Vibrations