Geometry & MOs

Info

ID:	309434
PubChem CID:	126546243
Reduced:	O2N3C19H25 (1)
Stoich.:	A2B3C19D25 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	-39.86
Dipole, Da:	1.66
IP(EA), eV:	-8.1(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butyl-2-fluorophenyl)oxan-4-amine

Drug info:

PubChemData

Smile

CN1CC=C(C=C1)C(=O)NC[C@H](CN2CCC3=CC=CC=C3C2)O

DOS

IR

Vibrations