Geometry & MOs

Info

ID:	225991
PubChem CID:	87246552
Reduced:	N3C11H27 (1)
Stoich.:	A3B11C27 (1)
Weight, g/mol:	225.048466
ΔH_f, kcal/mol:	-39.31
Dipole, Da:	2.12
IP(EA), eV:	-9.0(2.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl] nitrate

Drug info:

PubChemData

Smile

CCCCCCCCNCC(CN)N

DOS

IR

Vibrations