Geometry & MOs

Info

ID:	381343
PubChem CID:	134972049
Reduced:	BrN2O2C13H27 (1)
Stoich.:	AB2C2D13E27 (1)
Weight, g/mol:	504.232549
ΔH_f, kcal/mol:	-138.54
Dipole, Da:	4.15
IP(EA), eV:	-8.91(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[(1R)-2-amino-1-[6-(methoxymethyl)oxan-2-yl]oxyethyl]-2-(2-trimethylsilylethoxymethoxy)phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCN(CCCNC(=O)OC(C)(C)C)CCCBr

DOS

IR

Vibrations