Geometry & MOs

Info

ID:	227924
PubChem CID:	87563033
Reduced:	N2O3H24C26 (1)
Stoich.:	A2B3C24D26 (1)
Weight, g/mol:	645.209615
ΔH_f, kcal/mol:	32.33
Dipole, Da:	3.38
IP(EA), eV:	-8.87(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[(2-acetamido-3-methyl-3-nitrososulfanylbutanoyl)amino]pentyl-triphenyl-lambda5-phosphanyl] methanesulfonate

Drug info:

PubChemData

Smile

C1COCCN1CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)C4=CC(=CC=C4)C(=O)NO

DOS

IR

Vibrations