Geometry & MOs

Info

ID:	206862
PubChem CID:	80312171
Reduced:	S2N5C10H15 (1)
Stoich.:	A2B5C10D15 (1)
Weight, g/mol:	227.145619
ΔH_f, kcal/mol:	75.08
Dipole, Da:	4.54
IP(EA), eV:	-9.03(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-methyl-N-(2-methylpropyl)-N'-(1,3-thiazol-2-ylmethyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCCN1C(=NN=C1SCC2=NC=CS2)CN

DOS

IR

Vibrations