Geometry & MOs

Info

ID:	22059
PubChem CID:	595920
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	260.116092
ΔH_f, kcal/mol:	-69.56
Dipole, Da:	2.75
IP(EA), eV:	-9.05(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3,4-dihydro-2H-pyrrol-5-ylamino)ethanone

Drug info:

PubChemData

Smile

C1CC(=NC1)NCC(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations