Geometry & MOs

Info

ID:	204558
PubChem CID:	79983317
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	10.27
Dipole, Da:	5.5
IP(EA), eV:	-9.79(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclopropylphenyl)oxan-3-amine

Drug info:

PubChemData

Smile

CC(C#N)C(C1=CC=CC=C1C2CC2)O

DOS

IR

Vibrations