Geometry & MOs

Info

ID:	172384
PubChem CID:	75501924
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	341.126323
ΔH_f, kcal/mol:	-34.85
Dipole, Da:	2.79
IP(EA), eV:	-9.02(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-4-yl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)OCC2=C(OC=N2)C(C)C

DOS

IR

Vibrations