Geometry & MOs

Info

ID:	247160
PubChem CID:	103068314
Reduced:	S2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	242.091141
ΔH_f, kcal/mol:	58.55
Dipole, Da:	3.66
IP(EA), eV:	-8.93(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-propylprop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)NCC(=C)CSC1=NN=CS1

DOS

IR

Vibrations