Geometry & MOs

Info

ID:	23019
PubChem CID:	600884
Reduced:	NS2H13C19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	319.048942
ΔH_f, kcal/mol:	107.31
Dipole, Da:	2.99
IP(EA), eV:	-8.6(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(naphthalen-2-yliminomethyl)-1-benzothiophene-2-thiol

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)N=CC3=C(SC4=CC=CC=C43)S

DOS

IR

Vibrations