Geometry & MOs

Info

ID:	340439
PubChem CID:	127262450
Reduced:	N2S2O3C18H24 (1)
Stoich.:	A2B2C3D18E24 (1)
Weight, g/mol:	366.107185
ΔH_f, kcal/mol:	-88.19
Dipole, Da:	8.36
IP(EA), eV:	-9.41(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl carbamimidothioate;4-propan-2-ylbenzenesulfonic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)CSC(=N)N

DOS

IR

Vibrations