Geometry & MOs

Info

ID:	162089
PubChem CID:	57393587
Reduced:	O3N6H14C19 (1)
Stoich.:	A3B6C14D19 (1)
Weight, g/mol:	324.093249
ΔH_f, kcal/mol:	69.06
Dipole, Da:	3.07
IP(EA), eV:	-9.33(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NC2=CC=C(C=C2)C3=C4C(=NC=C3)N=CN4

DOS

IR

Vibrations