Geometry & MOs

Info

ID:	369439
PubChem CID:	127333383
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	333.168856
ΔH_f, kcal/mol:	-26.04
Dipole, Da:	5.73
IP(EA), eV:	-8.55(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-hydroxy-N-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCCC(C1)CN(C)C(=O)NC2=CC3=C(C=C2)OC(=N3)C4CC4

DOS

IR

Vibrations