Geometry & MOs

Info

ID:	390280
PubChem CID:	134998264
Reduced:	O2S2N3H9C14 (1)
Stoich.:	A2B2C3D9E14 (1)
Weight, g/mol:	330.04967
ΔH_f, kcal/mol:	108.2
Dipole, Da:	4.26
IP(EA), eV:	-8.91(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,3-dimethoxyphenyl)methanimine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)S/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations