Geometry & MOs

Info

ID:

141514

PubChem CID:

52886813

Reduced:

ClSN2O4C17H27 (1)

Stoich.:

ABC2D4E17F27 (1)

Weight, g/mol:

284.083078

ΔHf, kcal/mol:

-195.42

Dipole, Da:

6.66

IP(EA), eV:

-9.51(-0.45)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,N-dimethyl-2-oxo-3-propyl-1,3-benzoxazole-6-sulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(C)CCNS(=O)(=O)C1=CC=C(C=C1)CCCCl

DOS

IR

Vibrations