Geometry & MOs

Info

ID:	68600
PubChem CID:	46508736
Reduced:	N2O5C17H20 (1)
Stoich.:	A2B5C17D20 (1)
Weight, g/mol:	446.25292
ΔH_f, kcal/mol:	-148.47
Dipole, Da:	2.27
IP(EA), eV:	-8.47(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(4-methoxyphenoxy)-N-(3-methylbutyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)C(=O)NNC(=O)C(C)OC2=CC=C(C=C2)OC

DOS

IR

Vibrations