Geometry & MOs

Info

ID:	7808
PubChem CID:	74198
Reduced:	SN3C8H9 (1)
Stoich.:	AB3C8D9 (1)
Weight, g/mol:	179.051718
ΔH_f, kcal/mol:	71.24
Dipole, Da:	1.13
IP(EA), eV:	-8.76(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(benzylideneamino)carbamimidothioic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=NN=C(N)S

DOS

IR

Vibrations