Geometry & MOs

Info

ID:	287703
PubChem CID:	104252389
Reduced:	NOC12H25 (1)
Stoich.:	ABC12D25 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-85.43
Dipole, Da:	1.43
IP(EA), eV:	-8.55(2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-yl)-3-phenyl-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CCCNC(CC)CC1CCCCO1

DOS

IR

Vibrations