Geometry & MOs

Info

ID:	329367
PubChem CID:	126735524
Reduced:	ON2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	340.169939
ΔH_f, kcal/mol:	6.66
Dipole, Da:	3.16
IP(EA), eV:	-8.24(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-1-amino-3-iminoprop-1-en-2-yl]-N-[(1R)-1-(4-fluorophenyl)ethyl]-3-(methylamino)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=C(NN=C2)C)OC

DOS

IR

Vibrations