Geometry & MOs

Info

ID:	213693
PubChem CID:	81064682
Reduced:	OSN3C16H29 (1)
Stoich.:	ABC3D16E29 (1)
Weight, g/mol:	313.218784
ΔH_f, kcal/mol:	-22.93
Dipole, Da:	3.45
IP(EA), eV:	-8.4(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butan-2-yl-N-(2-ethoxyethyl)-N-methyl-5-(propylaminomethyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC(C)C1=C(SC(=N1)N(C)CCOCC)CNC2CC2

DOS

IR

Vibrations