Geometry & MOs

Info

ID:	26439
PubChem CID:	647847
Reduced:	N2O2C13H17 (2)
Stoich.:	A2B2C13D17 (2)
Weight, g/mol:	307.178358
ΔH_f, kcal/mol:	-148.12
Dipole, Da:	3.12
IP(EA), eV:	-9.04(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(cyclohexylamino)-4-methyl-1-oxopentan-2-yl] furan-2-carboxylate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N(CC(=O)NC2CCCCC2)C(=O)CCCC(=O)NC3=CC=CC=N3

DOS

IR

Vibrations