Geometry & MOs

Info

ID:	290182
PubChem CID:	104417630
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-8.74
Dipole, Da:	6.13
IP(EA), eV:	-8.82(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)-N-ethylpropanamide

Drug info:

PubChemData

Smile

CCNC(=O)CCNCC1=NC2=CC=CC=C2N1C

DOS

IR

Vibrations