Geometry & MOs

Info

ID:	267938
PubChem CID:	103590512
Reduced:	FN2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	220.112425
ΔH_f, kcal/mol:	-31.72
Dipole, Da:	1.99
IP(EA), eV:	-8.04(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-1-N-(1H-imidazol-5-ylmethyl)-5-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NC2CCC=CC2

DOS

IR

Vibrations