Geometry & MOs

Info

ID:	226715
PubChem CID:	87557036
Reduced:	ClO3C39H62 (2)
Stoich.:	AB3C39D62 (2)
Weight, g/mol:	375.290231
ΔH_f, kcal/mol:	-426.62
Dipole, Da:	7.92
IP(EA), eV:	-10.03(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(tetrabutyl-lambda5-phosphanyl) 2-acetamidoacetate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC(=O)CC(=O)C1=CC=CC=C1.CCCCCCCCCCCCCCCC(C)CC(=O)CC(=O)C1=CC=CC=C1.CCCCCCCCCCCCCCC(C(CC(=O)CC(=O)C1=CC=CC=C1)Cl)Cl

DOS

IR

Vibrations