Geometry & MOs

Info

ID:	26897
PubChem CID:	803764
Reduced:	SN2O2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-68.73
Dipole, Da:	4.5
IP(EA), eV:	-8.9(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3-methyl-5-propan-2-ylphenoxy)ethyl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)[C@@H]2C(=C(NC(=S)N2)C)C(=O)OC

DOS

IR

Vibrations