Geometry & MOs

Info

ID:	84017
PubChem CID:	49863325
Reduced:	NO3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	213.100108
ΔH_f, kcal/mol:	-171.28
Dipole, Da:	1.52
IP(EA), eV:	-10.1(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-butanoyl-5-hydroxy-2-(2-hydroxyethyl)-1,2-dihydropyrrol-3-one

Drug info:

PubChemData

Smile

CCCCCCCCCC(=O)C1=C(N[C@H](C1=O)C)O

DOS

IR

Vibrations