Geometry & MOs

Info

ID:	290519
PubChem CID:	104643459
Reduced:	ClNO3C16H22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	285.113171
ΔH_f, kcal/mol:	-121.32
Dipole, Da:	1.49
IP(EA), eV:	-8.72(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[(3-ethylmorpholin-4-yl)methyl]-6-methoxyphenol

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1O)CN2CCOC3C2CCCC3)Cl

DOS

IR

Vibrations