Geometry & MOs

Info

ID:	323500
PubChem CID:	126675041
Reduced:	ION2C3H7 (1)
Stoich.:	ABC2D3E7 (1)
Weight, g/mol:	510.264941
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	4.46
IP(EA), eV:	-9.69(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2R,5S)-5-[(2R,5R)-3,5-diamino-2-[(2S,5S)-3-amino-4,5-dihydroxy-6-[(1R)-1-hydroxyethyl]oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-3,4-dihydroxyoxolan-2-yl]methyl]guanidine

Drug info:

PubChemData

Smile

CNC(=O)NCI

DOS

IR

Vibrations