Geometry & MOs

Info

ID:	375356
PubChem CID:	131500070
Reduced:	N2O3C9H10 (1)
Stoich.:	A2B3C9D10 (1)
Weight, g/mol:	211.048072
ΔH_f, kcal/mol:	-59.03
Dipole, Da:	6.45
IP(EA), eV:	-10.38(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-5-methoxy-4-nitrophenyl)ethanone

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C(=O)O)C(=O)C2CC2

DOS

IR

Vibrations