Geometry & MOs

Info

ID:	133102
PubChem CID:	51477396
Reduced:	SN3O3C26H27 (1)
Stoich.:	AB3C3D26E27 (1)
Weight, g/mol:	461.177313
ΔH_f, kcal/mol:	-61.49
Dipole, Da:	6.75
IP(EA), eV:	-9.08(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)CN3C(=O)[C@](NC3=O)(CC)C4=CC=CC=C4

DOS

IR

Vibrations