Geometry & MOs

Info

ID:	144097
PubChem CID:	53311375
Reduced:	NO2H11C13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	532.184566
ΔH_f, kcal/mol:	-38.74
Dipole, Da:	7.64
IP(EA), eV:	-8.47(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]-1-phenyl-4-(3,4,5-trimethoxyphenyl)imidazol-2-one

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=CN(C(=O)N2C(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations