Geometry & MOs

Info

ID:	405648
PubChem CID:	135074759
Reduced:	NO3H19C21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	343.193614
ΔH_f, kcal/mol:	-43.32
Dipole, Da:	4.23
IP(EA), eV:	-8.91(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,E)-N-(3-cyclohexyl-1-phenylprop-2-ynoxy)-3-phenylprop-2-en-1-imine

Drug info:

PubChemData

Smile

CC1(CC1(C(=O)N2C=CC3=CC=CC=C32)C(=O)OC)C4=CC=CC=C4

DOS

IR

Vibrations