Geometry & MOs

Info

ID:	49013
PubChem CID:	11528614
Reduced:	NO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	215.1674
ΔH_f, kcal/mol:	-47.1
Dipole, Da:	2.87
IP(EA), eV:	-9.4(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-1-phenylprop-1-en-2-yl]cyclohexanamine

Drug info:

PubChemData

Smile

C1C=CC(=O)N1C(=O)CCC2=CC=CC=C2

DOS

IR

Vibrations