Geometry & MOs

Info

ID:	224505
PubChem CID:	85344048
Reduced:	SiO9C45H72 (1)
Stoich.:	AB9C45D72 (1)
Weight, g/mol:	787.328453
ΔH_f, kcal/mol:	-501.62
Dipole, Da:	8.42
IP(EA), eV:	-8.97(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,7-bis[4-(dimethylamino)phenyl]-5-hydroxyhepta-1,4,6-trien-3-one;copper

Drug info:

PubChemData

Smile

CCC(C(C)C1C(C(OC(O1)C2=C(C=C(C=C2C)C)C)C(C)CC(C)(C3C(C(OC(O3)C4=CC=C(C=C4)OC)C(C)C(=O)O)C)O[Si](C)(C)C(C)(C)C)C)O

DOS

IR

Vibrations