Geometry & MOs

Info

ID:	372366
PubChem CID:	131296609
Reduced:	ClNOC11H14 (1)
Stoich.:	ABCD11E14 (1)
Weight, g/mol:	211.040006
ΔH_f, kcal/mol:	-34.97
Dipole, Da:	1.68
IP(EA), eV:	-9.29(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-(ethoxymethyl)-2-hydroxybenzonitrile

Drug info:

PubChemData

Smile

C1COC2=C(CC1CN)C(=CC=C2)Cl

DOS

IR

Vibrations