Geometry & MOs

Info

ID:	425602
PubChem CID:	135126916
Reduced:	OSN2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	115.099714
ΔH_f, kcal/mol:	12.76
Dipole, Da:	2.75
IP(EA), eV:	-8.33(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-ethylpyrrolidin-2-ol

Drug info:

PubChemData

Smile

CNCCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31

DOS

IR

Vibrations