Geometry & MOs

Info

ID:	271542
PubChem CID:	103682907
Reduced:	NSBr2O2C13H19 (1)
Stoich.:	ABC2D2E13F19 (1)
Weight, g/mol:	285.139865
ΔH_f, kcal/mol:	-68.3
Dipole, Da:	5.93
IP(EA), eV:	-8.83(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dimethoxyphenyl)methylamino]-2-methyl-3-methylsulfanylpropan-2-ol

Drug info:

PubChemData

Smile

CC(CNCC1=C(C(=CC(=C1)Br)Br)OC)(CSC)O

DOS

IR

Vibrations