Geometry & MOs

Info

ID:	292822
PubChem CID:	117359458
Reduced:	NF2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	243.107085
ΔH_f, kcal/mol:	-185.51
Dipole, Da:	4.79
IP(EA), eV:	-9.91(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-4-[4-(1,1-difluoroethyl)phenyl]butanoic acid

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1C(CCC(=O)O)N)(F)F

DOS

IR

Vibrations