Geometry & MOs

Info

ID:	221377
PubChem CID:	85272327
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	232.084792
ΔH_f, kcal/mol:	-77.33
Dipole, Da:	4.02
IP(EA), eV:	-8.55(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-diazo-3-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)propan-2-one

Drug info:

PubChemData

Smile

C1C(CN2C1=C(N(C2=O)C3=CC=CC=C3)O)O

DOS

IR

Vibrations