Geometry & MOs

Info

ID:

360006

PubChem CID:

127300152

Reduced:

SN3O4C13H25 (1)

Stoich.:

AB3C4D13E25 (1)

Weight, g/mol:

310.132885

ΔHf, kcal/mol:

-182.6

Dipole, Da:

4.1

IP(EA), eV:

-10.0(0.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(1,4-dioxan-2-ylmethyl)-3-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)urea

Drug info:

PubChemData

Smile

C1CC(C1)CNS(=O)(=O)CCNC(=O)NC2CCOCC2

DOS

IR

Vibrations