Geometry & MOs

Info

ID:	292392
PubChem CID:	115001261
Reduced:	O4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	238.131742
ΔH_f, kcal/mol:	-164.13
Dipole, Da:	4.77
IP(EA), eV:	-9.32(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methyl-1,2-oxazol-5-yl)methylamino]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC(C)(CCOC)C(=O)O

DOS

IR

Vibrations