Geometry & MOs

Info

ID:	135386
PubChem CID:	51865024
Reduced:	ClSO2N3C20H27 (1)
Stoich.:	ABC2D3E20F27 (1)
Weight, g/mol:	366.172562
ΔH_f, kcal/mol:	-37.74
Dipole, Da:	10.6
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.967433
Charge, e:	0

Chem-info

IUPAC name:

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)NC[C@H](C1=CC=CS1)[NH+](C)C)NC(=O)C2=CC=CC=C2Cl

DOS

IR

Vibrations