Geometry & MOs

Info

ID:	281182
PubChem CID:	103911292
Reduced:	NOSC11H19 (1)
Stoich.:	ABCD11E19 (1)
Weight, g/mol:	269.118257
ΔH_f, kcal/mol:	-19.92
Dipole, Da:	2.07
IP(EA), eV:	-8.89(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chlorophenyl)-2-[(2-methyloxan-4-yl)amino]ethanol

Drug info:

PubChemData

Smile

CC1CC(CCO1)NCCSCC#C

DOS

IR

Vibrations