Geometry & MOs

Info

ID:	218804
PubChem CID:	85090000
Reduced:	BClN3O4C26H47 (1)
Stoich.:	ABC3D4E26F47 (1)
Weight, g/mol:	512.146086
ΔH_f, kcal/mol:	-334.24
Dipole, Da:	3.54
IP(EA), eV:	-9.41(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4-amino-2-oxopyrimidin-1-yl)-2-(9H-fluoren-9-ylmethoxycarbonyloxymethyl)oxolan-3-yl]oxyphosphonamidous acid

Drug info:

PubChemData

Smile

B1(OC2CC3CC(C3(C)C)C2(O1)C)C(CC)NC(=O)C(CC(C)C)N4CCC(C4=O)(C(C)C)N.Cl

DOS

IR

Vibrations