Geometry & MOs

Info

ID:	213697
PubChem CID:	81064688
Reduced:	SO2N3C15H29 (1)
Stoich.:	AB2C3D15E29 (1)
Weight, g/mol:	313.218784
ΔH_f, kcal/mol:	-78.3
Dipole, Da:	0.98
IP(EA), eV:	-8.37(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butan-2-yl-N-(2-ethoxyethyl)-N-methyl-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCCC1=C(SC(=N1)N(C)CCOCC)CNCCOC

DOS

IR

Vibrations