Geometry & MOs

Info

ID:	18341
PubChem CID:	539726
Reduced:	S2N3C10H17 (1)
Stoich.:	A2B3C10D17 (1)
Weight, g/mol:	243.08639
ΔH_f, kcal/mol:	29.37
Dipole, Da:	3.51
IP(EA), eV:	-8.55(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dipropyl-N'-(1,3-thiazol-2-yl)carbamimidothioic acid

Drug info:

PubChemData

Smile

CCCN(CCC)C(=NC1=NC=CS1)S

DOS

IR

Vibrations