Geometry & MOs

Info

ID:	195966
PubChem CID:	78755024
Reduced:	SO2N5C17H17 (1)
Stoich.:	AB2C5D17E17 (1)
Weight, g/mol:	417.237604
ΔH_f, kcal/mol:	108.28
Dipole, Da:	2.44
IP(EA), eV:	-9.29(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2C(=NN=N2)SC(C)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations