Geometry & MOs

Info

ID:	376917
PubChem CID:	134222950
Reduced:	FO4N7C24H28 (1)
Stoich.:	AB4C7D24E28 (1)
Weight, g/mol:	455.257277
ΔH_f, kcal/mol:	-123.43
Dipole, Da:	4.32
IP(EA), eV:	-9.51(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-ethenyl-5-[[1-[4-ethenyl-3-[(Z)-prop-1-enyl]phenyl]ethenylamino]methyl]phenyl]methyl-methylamino]piperidine-2,6-dione

Drug info:

PubChemData

Smile

C1CC(C(C1)O)NC(C2CC(CN2C(=O)CN3C4=C(C=C(C=C4)C5=CN=NC=C5)C(=N3)C(=O)N)F)O

DOS

IR

Vibrations