Geometry & MOs

Info

ID:	258738
PubChem CID:	103156702
Reduced:	SN2O3C10H22 (1)
Stoich.:	AB2C3D10E22 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-134.13
Dipole, Da:	7.01
IP(EA), eV:	-8.45(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(1R)-1-aminoethyl]phenoxy]-3-cyclopentylpropan-2-ol

Drug info:

PubChemData

Smile

CC(CCNC(=O)CC(CN)OC)S(=O)C

DOS

IR

Vibrations