Geometry & MOs

Info

ID:	281998
PubChem CID:	103914648
Reduced:	NOSC13H19 (1)
Stoich.:	ABCD13E19 (1)
Weight, g/mol:	195.092915
ΔH_f, kcal/mol:	-41.13
Dipole, Da:	3.01
IP(EA), eV:	-8.28(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(1-methylsulfonylpropan-2-ylamino)propan-2-ol

Drug info:

PubChemData

Smile

CC1CSC2=CC=CC=C2C1NC[C@H](C)O

DOS

IR

Vibrations