Geometry & MOs

Info

ID:	268234
PubChem CID:	103598502
Reduced:	ClSN2O3H15C16 (1)
Stoich.:	ABC2D3E15F16 (1)
Weight, g/mol:	365.119798
ΔH_f, kcal/mol:	-59.75
Dipole, Da:	5.99
IP(EA), eV:	-8.99(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CNC(=O)C=CC2=CC3=C(C(=C2)Cl)OCCO3

DOS

IR

Vibrations