Geometry & MOs

Info

ID:	265704
PubChem CID:	103541117
Reduced:	SN3O4C13H23 (1)
Stoich.:	AB3C4D13E23 (1)
Weight, g/mol:	319.088972
ΔH_f, kcal/mol:	-158.97
Dipole, Da:	4.46
IP(EA), eV:	-9.35(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CCCO)C)S(=O)(=O)N2CCC(C2)OC

DOS

IR

Vibrations