Geometry & MOs

Info

ID:

175362

PubChem CID:

75888904

Reduced:

NO3C12H14 (2)

Stoich.:

AB3C12D14 (2)

Weight, g/mol:

375.055878

ΔHf, kcal/mol:

-215.58

Dipole, Da:

1.8

IP(EA), eV:

-8.28(-0.01)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(1,3-dimethyl-2,6-dioxo-1,3-diazinan-4-yl)methyl 3-(methanesulfonamido)thiophene-2-carboxylate

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2CCC(NC2=O)C3=CC=CC=C3)OC

DOS

IR

Vibrations