Geometry & MOs

Info

ID:	171938
PubChem CID:	75443990
Reduced:	SO3N4C16H20 (1)
Stoich.:	AB3C4D16E20 (1)
Weight, g/mol:	314.0266
ΔH_f, kcal/mol:	-68.52
Dipole, Da:	3.15
IP(EA), eV:	-9.31(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-2-[(2-methoxyacetyl)-methylamino]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=CNN=C3)C(=O)N

DOS

IR

Vibrations