Geometry & MOs

Info

ID:	281508
PubChem CID:	103913969
Reduced:	O2N3C16H25 (1)
Stoich.:	A2B3C16D25 (1)
Weight, g/mol:	253.134779
ΔH_f, kcal/mol:	-70.12
Dipole, Da:	3.47
IP(EA), eV:	-9.26(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2-methyl-1-(1-methylsulfonylpropan-2-ylamino)butan-2-ol

Drug info:

PubChemData

Smile

CN(C)C(=O)N1CCC(CC1)N[C@H](CO)C2=CC=CC=C2

DOS

IR

Vibrations