Geometry & MOs

Info

ID:	360981
PubChem CID:	127301812
Reduced:	N3O3C16H19 (1)
Stoich.:	A3B3C16D19 (1)
Weight, g/mol:	356.070989
ΔH_f, kcal/mol:	-57.42
Dipole, Da:	7.61
IP(EA), eV:	-9.65(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-2-oxoethyl]imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)C2=CC=C(C=C2)C3=NC(=O)ON3)C

DOS

IR

Vibrations