Geometry & MOs

Info

ID:	383670
PubChem CID:	134975525
Reduced:	SN3O3C9H15 (1)
Stoich.:	AB3C3D9E15 (1)
Weight, g/mol:	189.996762
ΔH_f, kcal/mol:	-23.16
Dipole, Da:	7.7
IP(EA), eV:	-9.27(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(chloromethyl)-2-imino-1,3-thiazol-3-yl]ethanone

Drug info:

PubChemData

Smile

CCN(CC)CCOC1=NC=C(S1)[N+](=O)[O-]

DOS

IR

Vibrations