Geometry & MOs

Info

ID:	194325
PubChem CID:	78516635
Reduced:	N2O3C22H27 (1)
Stoich.:	A2B3C22D27 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	-45.41
Dipole, Da:	3.94
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.983792
Charge, e:	0

Chem-info

IUPAC name:

2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-phenyl-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1)NC3=C2CC[NH2+]C3C4=CC(=C(C(=C4)OC)OC)OC

DOS

IR

Vibrations