Geometry & MOs

Info

ID:	26910
PubChem CID:	804200
Reduced:	O2H7C11 (2)
Stoich.:	A2B7C11 (2)
Weight, g/mol:	311.115758
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	2.86
IP(EA), eV:	-9.03(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl]amino]benzoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C(C2=O)C3(C4=CC=CC=C4OC5=CC=CC=C53)O

DOS

IR

Vibrations