Geometry & MOs

Info

ID:	7675
PubChem CID:	73699
Reduced:	S2N4C9H12 (1)
Stoich.:	A2B4C9D12 (1)
Weight, g/mol:	240.050339
ΔH_f, kcal/mol:	46.68
Dipole, Da:	0.32
IP(EA), eV:	-8.45(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-[[amino(sulfanyl)methylidene]amino]-4-methylphenyl]carbamimidothioic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N=C(N)S)N=C(N)S

DOS

IR

Vibrations