Geometry & MOs

Info

ID:	23153
PubChem CID:	602518
Reduced:	S2N3O3H11C15 (1)
Stoich.:	A2B3C3D11E15 (1)
Weight, g/mol:	345.024184
ΔH_f, kcal/mol:	30.15
Dipole, Da:	1.99
IP(EA), eV:	-9.06(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations