Geometry & MOs

Info

ID:	312172
PubChem CID:	126603448
Reduced:	OSN2C9H20 (1)
Stoich.:	ABC2D9E20 (1)
Weight, g/mol:	181.091435
ΔH_f, kcal/mol:	-72.49
Dipole, Da:	4.98
IP(EA), eV:	-8.82(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2S)-4,4-difluoropyrrolidin-2-yl]propane-1,1-diol

Drug info:

PubChemData

Smile

CC(CCC(C)N(C)S)NC(=O)C

DOS

IR

Vibrations