Geometry & MOs

Info

ID:	61011
PubChem CID:	26704257
Reduced:	O3N6C25H32 (1)
Stoich.:	A3B6C25D32 (1)
Weight, g/mol:	446.25292
ΔH_f, kcal/mol:	-66.9
Dipole, Da:	9.19
IP(EA), eV:	-8.99(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)/C=C/C2=CN(N=C2)CC3=CC=CC=C3)N

DOS

IR

Vibrations