Geometry & MOs

Info

ID:	30297
PubChem CID:	841102
Reduced:	ClNSO3C16H16 (1)
Stoich.:	ABCD3E16F16 (1)
Weight, g/mol:	243.029835
ΔH_f, kcal/mol:	-107.7
Dipole, Da:	2.71
IP(EA), eV:	-8.76(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-chloro-4-(hydroxyiminomethyl)-6-methoxyphenyl] acetate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(S1)NC(=O)C2=CC=CC=C2Cl)C(=O)OC

DOS

IR

Vibrations