Geometry & MOs

Info

ID:	265705
PubChem CID:	103541147
Reduced:	FNSO5C13H18 (1)
Stoich.:	ABCD5E13F18 (1)
Weight, g/mol:	308.140593
ΔH_f, kcal/mol:	-230.33
Dipole, Da:	4.33
IP(EA), eV:	-9.51(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3,4-dimethoxypyrrolidin-1-yl)sulfonylpiperidin-3-yl]methanol

Drug info:

PubChemData

Smile

COC1CN(CC1OC)S(=O)(=O)C2=C(C=CC(=C2)CO)F

DOS

IR

Vibrations