Geometry & MOs

Info

ID:	337585
PubChem CID:	127258208
Reduced:	SN4O4C22H32 (1)
Stoich.:	AB4C4D22E32 (1)
Weight, g/mol:	296.001386
ΔH_f, kcal/mol:	-137.45
Dipole, Da:	6.87
IP(EA), eV:	-8.51(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N'-(3,5-diamino-6-chloropyrazine-2-carbonyl)carbamimidothioate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NN)O)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations