Geometry & MOs

Info

ID:	286975
PubChem CID:	104231654
Reduced:	NSO2C15H25 (1)
Stoich.:	ABC2D15E25 (1)
Weight, g/mol:	269.14495
ΔH_f, kcal/mol:	-80.66
Dipole, Da:	3.52
IP(EA), eV:	-8.2(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-methoxy-6-[methyl(1-methylsulfanylpropan-2-yl)amino]phenyl]ethanol

Drug info:

PubChemData

Smile

CCC(CSC)N(C)C1=C(C(=CC=C1)OC)[C@@H](C)O

DOS

IR

Vibrations