Geometry & MOs

Info

ID:	271740
PubChem CID:	103690304
Reduced:	NSO5C25H29 (1)
Stoich.:	ABC5D25E29 (1)
Weight, g/mol:	195.069557
ΔH_f, kcal/mol:	-195.33
Dipole, Da:	7.49
IP(EA), eV:	-8.71(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-3-fluorophenyl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(C1)(CSCCC(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)O

DOS

IR

Vibrations