Geometry & MOs

Info

ID:	28226
PubChem CID:	826400
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	247.193614
ΔH_f, kcal/mol:	-56.12
Dipole, Da:	2.5
IP(EA), eV:	-8.85(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2,2-dimethyl-N-[(2S)-1-phenylpropan-2-yl]oxan-4-amine

Drug info:

PubChemData

Smile

C[C@H](CC1=CC=CC=C1)N[C@H]2CCOC(C2)(C)C

DOS

IR

Vibrations