Geometry & MOs

Info

ID:	281269
PubChem CID:	103913628
Reduced:	SN2O3C13H22 (1)
Stoich.:	AB2C3D13E22 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-107.85
Dipole, Da:	4.61
IP(EA), eV:	-8.9(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(2-methoxy-1-phenylethyl)amino]methyl]-4-methylcyclohexan-1-ol

Drug info:

PubChemData

Smile

COCC(C1=CC=CC=C1)NCCCNS(=O)(=O)C

DOS

IR

Vibrations