Geometry & MOs

Info

ID:	32041
PubChem CID:	4254109
Reduced:	NO5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	446.231791
ΔH_f, kcal/mol:	-143.43
Dipole, Da:	4.76
IP(EA), eV:	-8.46(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5-[N-(1-benzylpiperidin-4-yl)-C-ethylcarbonimidoyl]-6-hydroxypyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C4=CC=CC=C4OC)O2

DOS

IR

Vibrations