Geometry & MOs

Info

ID:	327539
PubChem CID:	126690289
Reduced:	FON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	167.074642
ΔH_f, kcal/mol:	-22.72
Dipole, Da:	5.64
IP(EA), eV:	-9.72(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorocyclohepta-1,3,5-trien-1-yl)methyl]formamide

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C=N1)C/C/2=C/C=C(\CC=CC2)/F

DOS

IR

Vibrations