Geometry & MOs

Info

ID:	145436
PubChem CID:	53524813
Reduced:	NO4C13H19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	364.15537
ΔH_f, kcal/mol:	-141.25
Dipole, Da:	1.41
IP(EA), eV:	-8.3(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)COCCOC

DOS

IR

Vibrations