Geometry & MOs

Info

ID:	21534
PubChem CID:	588866
Reduced:	ClSN2O2H11C13 (1)
Stoich.:	ABC2D2E11F13 (1)
Weight, g/mol:	294.022977
ΔH_f, kcal/mol:	-8.64
Dipole, Da:	6.15
IP(EA), eV:	-8.76(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[1-(5-chlorothiophen-2-yl)ethylidene]hydrazinyl]benzoic acid

Drug info:

PubChemData

Smile

CC(=NNC1=CC=CC=C1C(=O)O)C2=CC=C(S2)Cl

DOS

IR

Vibrations