Geometry & MOs

Info

ID:	134072
PubChem CID:	51636919
Reduced:	NO2C13H13 (2)
Stoich.:	AB2C13D13 (2)
Weight, g/mol:	442.148849
ΔH_f, kcal/mol:	-90.9
Dipole, Da:	2.9
IP(EA), eV:	-8.71(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-2-[(4S)-4-methyl-4-(4-nitrophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCCC1)OC(=O)C2=C3CCC/C(=C\C4=CC=CO4)/C3=NC5=CC=CC=C52

DOS

IR

Vibrations