Geometry & MOs

Info

ID:	169616
PubChem CID:	75126417
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	444.183127
ΔH_f, kcal/mol:	-66.24
Dipole, Da:	4.26
IP(EA), eV:	-9.34(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-amino-1-(2-methoxyethyl)-2,4-dioxo-1,3-diazinan-5-yl]-N-benzyl-5-ethyl-4-methylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN(C(=O)C1CCN(CC1)C(=O)C=CC2=CC=CC=C2)OC

DOS

IR

Vibrations