Geometry & MOs

Info

ID:	261881
PubChem CID:	103256680
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	275.188529
ΔH_f, kcal/mol:	-119.68
Dipole, Da:	3.95
IP(EA), eV:	-9.21(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[(2,2-dimethylcyclopentyl)amino]methyl]phenyl]propanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC=C(O1)C(=O)OC)NC2CCCC2(C)C

DOS

IR

Vibrations