Geometry & MOs

Info

ID:	201390
PubChem CID:	79532343
Reduced:	FNO3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	265.179027
ΔH_f, kcal/mol:	-128.5
Dipole, Da:	3.77
IP(EA), eV:	-8.22(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-imidazol-1-ylpropylamino)methyl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)F)O

DOS

IR

Vibrations