Geometry & MOs

Info

ID:	21925
PubChem CID:	593902
Reduced:	SN4C11H12 (1)
Stoich.:	AB4C11D12 (1)
Weight, g/mol:	232.078268
ΔH_f, kcal/mol:	75.25
Dipole, Da:	3.7
IP(EA), eV:	-8.14(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(2-methyl-1H-indol-3-yl)methylideneamino]carbamimidothioic acid

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C=NN=C(N)S

DOS

IR

Vibrations