Geometry & MOs

Info

ID:	186107
PubChem CID:	77390831
Reduced:	OF2N5H31C33 (1)
Stoich.:	AB2C5D31E33 (1)
Weight, g/mol:	287.188529
ΔH_f, kcal/mol:	6.55
Dipole, Da:	8.1
IP(EA), eV:	-9.06(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-hydroxycyclohexyl)-6-phenylhex-2-enamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=C(C=NN2C3=CC=C(C=C3)F)C(=O)N4CCC(C4)C5=CC=CC=C5)CC6=CC(=C(C=C6)C#N)F

DOS

IR

Vibrations