Geometry & MOs

Info

ID:	261764
PubChem CID:	103249914
Reduced:	NO2F3C8H12 (1)
Stoich.:	AB2C3D8E12 (1)
Weight, g/mol:	279.183444
ΔH_f, kcal/mol:	-237.36
Dipole, Da:	4.15
IP(EA), eV:	-9.7(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1-cyclohexylpropylamino)methyl]-3-methylfuran-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC1NCC(C(=O)O)C(F)(F)F

DOS

IR

Vibrations