Geometry & MOs

Info

ID:	408337
PubChem CID:	135081103
Reduced:	NSCl5H6C10 (1)
Stoich.:	ABC5D6E10 (1)
Weight, g/mol:	227.047984
ΔH_f, kcal/mol:	24.57
Dipole, Da:	5.56
IP(EA), eV:	-8.79(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dichloro-1-morpholin-4-ylbutan-1-ol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N)S/C(=C(\C(=C(Cl)Cl)Cl)/Cl)/Cl

DOS

IR

Vibrations