Geometry & MOs

Info

ID:	222716
PubChem CID:	85332078
Reduced:	NOC7H7 (4)
Stoich.:	ABC7D7 (4)
Weight, g/mol:	484.01261
ΔH_f, kcal/mol:	-40.03
Dipole, Da:	9.88
IP(EA), eV:	-8.98(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2-bromophenyl)phenyl]sulfonyl-N-hydroxy-2,2-dimethylthiomorpholine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)N2C(=O)C(C(=N2)C(C)(C)C)NN=C3C=CC=C(C3=O)C4=CC(=CC=C4)C(=O)O)C

DOS

IR

Vibrations