Geometry & MOs

Info

ID:	293813
PubChem CID:	117402812
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	259.193614
ΔH_f, kcal/mol:	-30.68
Dipole, Da:	2.17
IP(EA), eV:	-8.81(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(oxan-4-yl)phenyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)CC2CCCN2)OCC3CC3)C

DOS

IR

Vibrations