Geometry & MOs

Info

ID:	203543
PubChem CID:	79842834
Reduced:	N2O2S2C11H20 (1)
Stoich.:	A2B2C2D11E20 (1)
Weight, g/mol:	359.04807
ΔH_f, kcal/mol:	-69.83
Dipole, Da:	4.83
IP(EA), eV:	-8.98(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromo-2-methyl-6-nitrophenoxy)-2-methyl-2-(methylamino)butanamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(CN)N(C)CCS(=O)(=O)C

DOS

IR

Vibrations