Geometry & MOs

Info

ID:	293282
PubChem CID:	117381509
Reduced:	NO3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	251.152144
ΔH_f, kcal/mol:	-108.76
Dipole, Da:	2.83
IP(EA), eV:	-8.65(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(dimethylamino)-5-methoxyphenyl]-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)O)CC2CCCCN2

DOS

IR

Vibrations