Geometry & MOs

Info

ID:	144253
PubChem CID:	53338591
Reduced:	SN3O5C17H23 (1)
Stoich.:	AB3C5D17E23 (1)
Weight, g/mol:	131.094629
ΔH_f, kcal/mol:	-174.48
Dipole, Da:	4.21
IP(EA), eV:	-8.77(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3S)-2-methylmorpholin-3-yl]methanol

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=S)N2CCN(CC2)CCO

DOS

IR

Vibrations