Geometry & MOs

Info

ID:	448570
PubChem CID:	135291964
Reduced:	ON2C9H18 (1)
Stoich.:	AB2C9D18 (1)
Weight, g/mol:	262.088832
ΔH_f, kcal/mol:	-25.34
Dipole, Da:	1.38
IP(EA), eV:	-8.65(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-azetidin-2-yl]-[(3-phenyl-1,2,4-thiadiazol-5-yl)amino]methanol

Drug info:

PubChemData

Smile

CC(C)(C)/C(=C/OCNC)/N=C

DOS

IR

Vibrations