Geometry & MOs

Info

ID:	374408
PubChem CID:	131328597
Reduced:	NOS2H9C12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	226.087291
ΔH_f, kcal/mol:	42.53
Dipole, Da:	2.89
IP(EA), eV:	-9.17(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2-chloropyridin-3-yl)ethyl]morpholine

Drug info:

PubChemData

Smile

CSC1=C(C2=CC=CC(=C2S1)C=O)CC#N

DOS

IR

Vibrations