Geometry & MOs

Info

ID:	229341
PubChem CID:	87567439
Reduced:	O2C10H19 (2)
Stoich.:	A2B10C19 (2)
Weight, g/mol:	533.1561
ΔH_f, kcal/mol:	-253.21
Dipole, Da:	3.86
IP(EA), eV:	-10.56(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2S)-2-(2-aminoethylsulfonylamino)-3-oxo-3-(4-phenylbutylamino)propyl]phenoxy]-(difluoromethyl)phosphinic acid

Drug info:

PubChemData

Smile

CCC(CC)CC(CCCC(C)C(=O)O)(CC(CC)CC)C(=O)O

DOS

IR

Vibrations