Geometry & MOs

Info

ID:	447198
PubChem CID:	135281106
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	607.257801
ΔH_f, kcal/mol:	-130.33
Dipole, Da:	6.45
IP(EA), eV:	-9.43(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[2-[2-(6-chlorohexoxy)ethoxy]ethylamino]-3-oxopropyl]-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]phosphinate

Drug info:

PubChemData

Smile

CN(CCCCCC(=O)O)C(=O)C=C

DOS

IR

Vibrations