Geometry & MOs

Info

ID:	293816
PubChem CID:	117402855
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	259.193614
ΔH_f, kcal/mol:	-23.52
Dipole, Da:	2.85
IP(EA), eV:	-8.76(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(oxolan-3-yl)phenyl]cyclohexyl]methanamine

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)C2CCNCC2)OCC3CC3)C

DOS

IR

Vibrations