Geometry & MOs

Info

ID:	292040
PubChem CID:	114148400
Reduced:	O2N3C13H27 (1)
Stoich.:	A2B3C13D27 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	-87.77
Dipole, Da:	3.42
IP(EA), eV:	-8.93(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(4-hydroxycyclohexyl)methylamino]methyl]-3-methylfuran-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(CCNCC1CCCC(C1)O)C(=NO)N

DOS

IR

Vibrations