Geometry & MOs

Info

ID:	447166
PubChem CID:	135280883
Reduced:	NSO2C4H9 (1)
Stoich.:	ABC2D4E9 (1)
Weight, g/mol:	716.369132
ΔH_f, kcal/mol:	-76.82
Dipole, Da:	2.74
IP(EA), eV:	-8.69(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2,2-bis[[3-(1,3-dihydroxypropan-2-ylamino)-3-oxopropoxy]methyl]-3-[3-(2,3-dihydroxypropylamino)-3-oxopropoxy]propoxy]-N-(2,3-dihydroxypropyl)propanamide

Drug info:

PubChemData

Smile

CSN1COCOC1

DOS

IR

Vibrations