Geometry & MOs

Info

ID:	439234
PubChem CID:	135229001
Reduced:	NOF3C16H22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	341.251878
ΔH_f, kcal/mol:	-217.08
Dipole, Da:	5.39
IP(EA), eV:	-9.23(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-2-[3-fluoro-2-[4-(4-methylcyclohexyl)pent-4-en-2-yl]phenyl]prop-1-enyl]ethanimine

Drug info:

PubChemData

Smile

CCC1CCN(CC1)C(CC2=CC=C(C=C2)C(F)(F)F)O

DOS

IR

Vibrations