Geometry & MOs

Info

ID:	183279
PubChem CID:	77001241
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	342.05791
ΔH_f, kcal/mol:	-92.43
Dipole, Da:	3.84
IP(EA), eV:	-9.23(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-2-methoxyphenyl)-6-hydroxy-5-propyl-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CCCC1C(NC(NC1=O)C2=C(C=CC(=C2)C)C)O

DOS

IR

Vibrations