Geometry & MOs

Info

ID:	287363
PubChem CID:	104239303
Reduced:	O2S2N3C12H15 (1)
Stoich.:	A2B2C3D12E15 (1)
Weight, g/mol:	234.082684
ΔH_f, kcal/mol:	-23.11
Dipole, Da:	3.31
IP(EA), eV:	-9.29(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-amino-2-phenylethyl)-1,3-thiazol-2-yl]methanol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(CC2=CSC(=N2)CS(=O)(=O)N)N

DOS

IR

Vibrations