Geometry & MOs

Info

ID:	446547
PubChem CID:	135275859
Reduced:	NS2O4C15H21 (1)
Stoich.:	AB2C4D15E21 (1)
Weight, g/mol:	253.93747
ΔH_f, kcal/mol:	-100.96
Dipole, Da:	6.01
IP(EA), eV:	-8.41(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-iodo-2-methyl-1,3-thiazol-5-yl)methanamine

Drug info:

PubChemData

Smile

CC1=COC2=C1OC(=CC2=S)N(CCO)CCSCCOC

DOS

IR

Vibrations