Geometry & MOs

Info

ID:	207789
PubChem CID:	80449766
Reduced:	SN2O2C15H24 (1)
Stoich.:	AB2C2D15E24 (1)
Weight, g/mol:	313.218784
ΔH_f, kcal/mol:	-97.11
Dipole, Da:	9.59
IP(EA), eV:	-8.75(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-butan-2-yl-2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-1,3-thiazol-5-yl]methanol

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C2=NC(=C(S2)C(=O)O)C(C)CC

DOS

IR

Vibrations