Geometry & MOs

Info

ID:	299184
PubChem CID:	117675961
Reduced:	ON2C8H10 (4)
Stoich.:	AB2C8D10 (4)
Weight, g/mol:	276.994235
ΔH_f, kcal/mol:	-57.42
Dipole, Da:	2.25
IP(EA), eV:	-8.49(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethylsulfonyl 3-(dichloroamino)-3-methylbutanoate

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=C(C=C(C=C2)NC3=NC(=CN=C3C(=O)N)OC4=CC=CC(=C4)NC(=O)C=C)CCCN5CCOCC5

DOS

IR

Vibrations