Geometry & MOs

Info

ID:	227470
PubChem CID:	87561812
Reduced:	O3C20H36 (1)
Stoich.:	A3B20C36 (1)
Weight, g/mol:	428.080709
ΔH_f, kcal/mol:	-160.22
Dipole, Da:	4.05
IP(EA), eV:	-9.61(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[formyl-[1-[(4-phenoxyphenyl)sulfonylamino]butyl]amino]phosphonic acid

Drug info:

PubChemData

Smile

CCC1[C@H](O1)CCCC/C=C\CCCCCCCCCC(=O)O

DOS

IR

Vibrations