Geometry & MOs

Info

ID:	261341
PubChem CID:	103227166
Reduced:	ON2C14H30 (1)
Stoich.:	AB2C14D30 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-71.07
Dipole, Da:	1.92
IP(EA), eV:	-8.33(2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-3-methoxy-N-propylpropan-1-amine

Drug info:

PubChemData

Smile

CCCC1CCCCN1C(CNCC)COC

DOS

IR

Vibrations