Geometry & MOs

Info

ID:	11310
PubChem CID:	113702
Reduced:	S2N3O4C10H17 (1)
Stoich.:	A2B3C4D10E17 (1)
Weight, g/mol:	307.066048
ΔH_f, kcal/mol:	-146.42
Dipole, Da:	2.56
IP(EA), eV:	-9.2(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-amino-1-phenylpropyl) carbamimidothioate;sulfuric acid

Drug info:

PubChemData

Smile

CC(C(C1=CC=CC=C1)SC(=N)N)N.OS(=O)(=O)O

DOS

IR

Vibrations