Geometry & MOs

Info

ID:	155232
PubChem CID:	56322927
Reduced:	FO3N5C24H34 (1)
Stoich.:	AB3C5D24E34 (1)
Weight, g/mol:	441.147075
ΔH_f, kcal/mol:	-182.49
Dipole, Da:	2.0
IP(EA), eV:	-8.29(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[5-(benzylamino)-3-(2-methoxyethyl)-2,6-dioxopyrimidin-4-yl]-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)F)N2CCN(CC2)C)NC(=O)CCN3C(=O)C4(CCCCC4)NC3=O

DOS

IR

Vibrations