Geometry & MOs

Info

ID:	270056
PubChem CID:	103624297
Reduced:	NO2C9H19 (1)
Stoich.:	AB2C9D19 (1)
Weight, g/mol:	227.188529
ΔH_f, kcal/mol:	-125.84
Dipole, Da:	6.09
IP(EA), eV:	-9.74(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-(pentan-2-ylamino)cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(C)NC(C)(C)C(=O)O

DOS

IR

Vibrations