Geometry & MOs

Info

ID:	265449
PubChem CID:	103521986
Reduced:	FSO2N3C13H20 (1)
Stoich.:	ABC2D3E13F20 (1)
Weight, g/mol:	329.09904
ΔH_f, kcal/mol:	-114.16
Dipole, Da:	6.42
IP(EA), eV:	-9.15(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-bromophenyl)propan-2-ylamino]-4-methoxy-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CC(C)(C)CCS(=O)(=O)NC1=CC(=C(C=C1)F)C(=N)N

DOS

IR

Vibrations