Geometry & MOs

Info

ID:	37816
PubChem CID:	8024808
Reduced:	NO2C23H25 (1)
Stoich.:	AB2C23D25 (1)
Weight, g/mol:	376.205873
ΔH_f, kcal/mol:	-20.77
Dipole, Da:	1.3
IP(EA), eV:	-8.63(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNCC2=CC=C(C=C2)OC[C@H](C3=CC=CC=C3)O

DOS

IR

Vibrations