Geometry & MOs

Info

ID:	12844
PubChem CID:	146683
Reduced:	SO2N3H7C9 (1)
Stoich.:	AB2C3D7E9 (1)
Weight, g/mol:	221.025898
ΔH_f, kcal/mol:	56.19
Dipole, Da:	7.45
IP(EA), eV:	-9.17(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nitro-N-phenyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2=NC=C(S2)[N+](=O)[O-]

DOS

IR

Vibrations