Geometry & MOs

Info

ID:	259199
PubChem CID:	103158581
Reduced:	O3C17H24 (1)
Stoich.:	A3B17C24 (1)
Weight, g/mol:	272.173607
ΔH_f, kcal/mol:	-132.36
Dipole, Da:	4.86
IP(EA), eV:	-9.44(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[(3-methylcyclohexyl)carbamoylamino]butanoic acid

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=CC=C1OCC(CC2CCCC2)O

DOS

IR

Vibrations