Geometry & MOs

Info

ID:	42482
PubChem CID:	8149607
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	307.148024
ΔH_f, kcal/mol:	-84.94
Dipole, Da:	5.57
IP(EA), eV:	-7.9(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl-propylazanium

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1O)OC(=O)C=C2CNC3=CC=C(C=C3)N4CCCCC4

DOS

IR

Vibrations