Geometry & MOs

Info

ID:	137927
PubChem CID:	52284678
Reduced:	N3O5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	436.166808
ΔH_f, kcal/mol:	-175.81
Dipole, Da:	5.33
IP(EA), eV:	-8.48(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[(3R)-1,1-dioxothiolan-3-yl]-5-oxo-N-[[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C(C)C)NC(=O)NCC2=CC(=C(C(=C2)OC)OC)OC

DOS

IR

Vibrations