Geometry & MOs

Info

ID:	292823
PubChem CID:	117359460
Reduced:	NF2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	243.107085
ΔH_f, kcal/mol:	-186.69
Dipole, Da:	5.05
IP(EA), eV:	-9.65(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-[4-(3,3-difluoropropyl)phenyl]propanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)C(CCC(=O)O)N)(F)F

DOS

IR

Vibrations