Geometry & MOs

Info

ID:	179355
PubChem CID:	76469530
Reduced:	N3O4H23C24 (1)
Stoich.:	A3B4C23D24 (1)
Weight, g/mol:	568.11853
ΔH_f, kcal/mol:	-27.73
Dipole, Da:	5.6
IP(EA), eV:	-9.1(-2.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-bromo-2,4-dioxo-1,3-diazinan-1-yl)but-2-enyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]oxymethyl 3,3-dimethylbutanoate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C2C=C3C(=NC2=C4C=CC(=O)C=C4O)NNC3=O)C=C(C1=O)C(C)C

DOS

IR

Vibrations