Geometry & MOs

Info

ID:	177357
PubChem CID:	76172558
Reduced:	N6O7C22H22 (1)
Stoich.:	A6B7C22D22 (1)
Weight, g/mol:	493.210052
ΔH_f, kcal/mol:	-154.03
Dipole, Da:	8.96
IP(EA), eV:	-8.92(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3,4-dimethoxyphenyl)-4-[3-(3,4-dimethoxyphenyl)prop-2-enoyl]-N-ethyl-5-hydroxyhepta-2,4,6-trienamide

Drug info:

PubChemData

Smile

CN(C)C1C2CC3CC4=C(C=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)N5C=NN=N5

DOS

IR

Vibrations