Geometry & MOs

Info

ID:	68985
PubChem CID:	46514773
Reduced:	SN2O4H16C18 (1)
Stoich.:	AB2C4D16E18 (1)
Weight, g/mol:	433.11077
ΔH_f, kcal/mol:	-114.5
Dipole, Da:	6.12
IP(EA), eV:	-9.05(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-3-thiophen-2-ylpropanoate

Drug info:

PubChemData

Smile

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC3=CC=CC=C3NC2=O

DOS

IR

Vibrations