Geometry & MOs

Info

ID:	244375
PubChem CID:	99344364
Reduced:	N2O4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	414.139548
ΔH_f, kcal/mol:	-133.41
Dipole, Da:	6.35
IP(EA), eV:	-8.78(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-cyclopropyl-2-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]ethyl]-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCC(=O)NC[C@H](C2CC2)NC(=O)CCC3=CC=C(C=C3)OC

DOS

IR

Vibrations