Geometry & MOs

Info

ID:	200187
PubChem CID:	79359536
Reduced:	SN2O3C15H26 (1)
Stoich.:	AB2C3D15E26 (1)
Weight, g/mol:	327.08339
ΔH_f, kcal/mol:	-124.35
Dipole, Da:	5.54
IP(EA), eV:	-9.44(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-bromo-6-[(cyclopropylamino)methyl]phenoxy]-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CCN1C=C(C=C1CO)S(=O)(=O)NCC2C(C2(C)C)(C)C

DOS

IR

Vibrations