Geometry & MOs

Info

ID:	55377
PubChem CID:	17395310
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	343.105587
ΔH_f, kcal/mol:	-75.79
Dipole, Da:	4.87
IP(EA), eV:	-8.93(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yloxy)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CNC(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations