Geometry & MOs

Info

ID:	165879
PubChem CID:	74609009
Reduced:	O3N10C22H34 (1)
Stoich.:	A3B10C22D34 (1)
Weight, g/mol:	436.214427
ΔH_f, kcal/mol:	-15.67
Dipole, Da:	11.21
IP(EA), eV:	-9.42(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-1,3-diazinan-5-yl]-N-butyl-5-oxo-5-thiophen-2-ylpentanamide

Drug info:

PubChemData

Smile

CCCCN(C1C(N(C(=O)NC1=O)CC(C)C)N)C(=O)C2CCN(CC2)C3=NN4C(=NN=N4)C=C3

DOS

IR

Vibrations