Geometry & MOs

Info

ID:	217818
PubChem CID:	85088430
Reduced:	O10C19H20 (1)
Stoich.:	A10B19C20 (1)
Weight, g/mol:	404.154328
ΔH_f, kcal/mol:	-394.91
Dipole, Da:	2.42
IP(EA), eV:	-8.99(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[[5-[[5-(2,4-dioxo-1,3-diazinan-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]-3,4-dihydroxyoxolan-2-yl]methyl]methanimidamide

Drug info:

PubChemData

Smile

C1C(CC2C(C1O)C(=O)C(=CO2)C3=CC=C(C=C3)O)OC(C(C(=O)O)O)C(=O)O

DOS

IR

Vibrations