Geometry & MOs

Info

ID:	271336
PubChem CID:	103654950
Reduced:	NSO4C11H23 (1)
Stoich.:	ABC4D11E23 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-196.29
Dipole, Da:	5.22
IP(EA), eV:	-9.59(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-propan-2-ylphenyl)methylamino]oxan-4-yl]methanol

Drug info:

PubChemData

Smile

CCCS(=O)(=O)CCNC1(CCOCC1)CO

DOS

IR

Vibrations