Geometry & MOs

Info

ID:	299208
PubChem CID:	117679526
Reduced:	N3O3C15H25 (1)
Stoich.:	A3B3C15D25 (1)
Weight, g/mol:	202.084124
ΔH_f, kcal/mol:	-110.47
Dipole, Da:	3.07
IP(EA), eV:	-9.2(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,4S,5R)-2,3,4,5-tetrahydroxynon-8-ynal

Drug info:

PubChemData

Smile

CCN(C1CCOCC1)C2=C(C(=NN2C)C(=O)OCC)C

DOS

IR

Vibrations