Geometry & MOs

Info

ID:	243667
PubChem CID:	99233779
Reduced:	N3O5C27H41 (1)
Stoich.:	A3B5C27D41 (1)
Weight, g/mol:	410.25292
ΔH_f, kcal/mol:	-249.22
Dipole, Da:	8.7
IP(EA), eV:	-8.82(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(3R)-1-[2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetyl]piperidin-3-yl]methyl]carbamate

Drug info:

PubChemData

Smile

CCCCN1[C@H]([C@H](CC1=O)C(=O)N2CCC[C@@H](C2)CNC(=O)OC(C)(C)C)C3=CC=C(C=C3)OC

DOS

IR

Vibrations