Geometry & MOs

Info

ID:	34084
PubChem CID:	7889753
Reduced:	N2O5C18H20 (1)
Stoich.:	A2B5C18D20 (1)
Weight, g/mol:	326.072513
ΔH_f, kcal/mol:	-165.23
Dipole, Da:	6.75
IP(EA), eV:	-9.03(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl pyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)COC(=O)C2=CC=NC=C2

DOS

IR

Vibrations