Geometry & MOs

Info

ID:	342560
PubChem CID:	127265715
Reduced:	FN2O2C13H13 (1)
Stoich.:	AB2C2D13E13 (1)
Weight, g/mol:	304.088164
ΔH_f, kcal/mol:	-55.69
Dipole, Da:	4.13
IP(EA), eV:	-9.84(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxy-4-methoxyphenyl)-N-methyl-N-(1,3-thiazol-2-ylmethyl)prop-2-enamide

Drug info:

PubChemData

Smile

C#CC(C1CCCO1)NC(=O)C2=C(C=NC=C2)F

DOS

IR

Vibrations