Geometry & MOs

Info

ID:	285024
PubChem CID:	104091248
Reduced:	O2C9H16 (1)
Stoich.:	A2B9C16 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	-72.92
Dipole, Da:	2.31
IP(EA), eV:	-10.01(1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylmorpholin-2-yl)hex-5-yn-1-ol

Drug info:

PubChemData

Smile

CC(C(CCCC#C)O)OC

DOS

IR

Vibrations