Geometry & MOs

Info

ID:	279627
PubChem CID:	103844496
Reduced:	ClNO4H14C15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-58.46
Dipole, Da:	3.41
IP(EA), eV:	-9.1(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(2-hydroxyethyl)phenoxy]methyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OCC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations