Geometry & MOs

Info

ID:	312401
PubChem CID:	126604694
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	454.088181
ΔH_f, kcal/mol:	-39.43
Dipole, Da:	2.34
IP(EA), eV:	-9.94(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[6-[cyclopropanecarbonyl(methyl)amino]pyridin-3-yl]oxy-N-hydrazinylidene-4,5-dihydrothieno[3,4-g][1,2]benzothiazole-6-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C=NCCCCO

DOS

IR

Vibrations