Geometry & MOs

Info

ID:	58669
PubChem CID:	24712446
Reduced:	SN2O3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	333.151098
ΔH_f, kcal/mol:	-73.34
Dipole, Da:	8.19
IP(EA), eV:	-8.95(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-2-[(3-ethylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC2=NC(=CS2)C(=O)N3CCCCC3)OC

DOS

IR

Vibrations