Geometry & MOs

Info

ID:	289821
PubChem CID:	104375827
Reduced:	SN2O6C7H14 (1)
Stoich.:	AB2C6D7E14 (1)
Weight, g/mol:	346.04475
ΔH_f, kcal/mol:	-254.52
Dipole, Da:	7.15
IP(EA), eV:	-10.15(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-bromo-2-chlorophenyl)ethylamino]-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

COCCNC(=O)CNS(=O)(=O)CC(=O)O

DOS

IR

Vibrations