Geometry & MOs

Info

ID:	28770
PubChem CID:	829494
Reduced:	FNO2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	290.105528
ΔH_f, kcal/mol:	-125.13
Dipole, Da:	1.44
IP(EA), eV:	-8.67(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1H-perimidin-2-yl)benzoic acid

Drug info:

PubChemData

Smile

C1CCN(CC1)C[C@@H](COCC2=CC=CC=C2F)O

DOS

IR

Vibrations