Geometry & MOs

Info

ID:	303278
PubChem CID:	124489448
Reduced:	NO4C14H25 (1)
Stoich.:	AB4C14D25 (1)
Weight, g/mol:	271.178358
ΔH_f, kcal/mol:	-229.13
Dipole, Da:	3.75
IP(EA), eV:	-10.1(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-2-ethyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC[C@@H]1CCCC[C@@]1(C(=O)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations