Geometry & MOs

Info

ID:	37594
PubChem CID:	8022527
Reduced:	ON2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-25.04
Dipole, Da:	4.03
IP(EA), eV:	-8.81(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-methoxyphenyl)-3-pyrrolidin-1-ylpropanoic acid

Drug info:

PubChemData

Smile

CC(C)N1C2=CC=CC=C2[C@H](C1=O)N

DOS

IR

Vibrations