Geometry & MOs

Info

ID:	264708
PubChem CID:	103484504
Reduced:	NO3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	243.147058
ΔH_f, kcal/mol:	-107.13
Dipole, Da:	2.27
IP(EA), eV:	-9.2(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[3-(hydroxymethyl)pyrrolidin-1-yl]-4-oxopentanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCC(=O)CN(CC1CC1)C2CC2

DOS

IR

Vibrations