Geometry & MOs

Info

ID:	176856
PubChem CID:	76105830
Reduced:	FN2O6C34H39 (1)
Stoich.:	AB2C6D34E39 (1)
Weight, g/mol:	191.079373
ΔH_f, kcal/mol:	-252.85
Dipole, Da:	4.64
IP(EA), eV:	-8.82(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5,6-trihydroxy-4-oxohexan-3-yl)formamide

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)C2C(C(CN2CC(=O)NC3=C(C=C(C=C3CC)F)CC)C4=CC5=C(C=C4)OCCO5)C(=O)O

DOS

IR

Vibrations