Geometry & MOs

Info

ID:

157356

PubChem CID:

56423116

Reduced:

N2F3O4C17H21 (1)

Stoich.:

A2B3C4D17E21 (1)

Weight, g/mol:

380.067822

ΔHf, kcal/mol:

-319.03

Dipole, Da:

8.58

IP(EA), eV:

-8.91(-0.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-4-methoxy-3-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2OCCO2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations