Geometry & MOs

Info

ID:	206025
PubChem CID:	80190312
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	279.199843
ΔH_f, kcal/mol:	-47.37
Dipole, Da:	1.84
IP(EA), eV:	-8.07(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-(3,3-diethylpyrrolidin-1-yl)-5-fluoro-4-methylphenyl]ethanol

Drug info:

PubChemData

Smile

CCC1(CCN(C1)C2=CC=CC=C2CO)CC

DOS

IR

Vibrations