Geometry & MOs

Info

ID:	231163
PubChem CID:	87572819
Reduced:	S2O8C45H80 (1)
Stoich.:	A2B8C45D80 (1)
Weight, g/mol:	663.010103
ΔH_f, kcal/mol:	-467.88
Dipole, Da:	2.99
IP(EA), eV:	-9.24(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentacosafluorotetradecan-1-amine

Drug info:

PubChemData

Smile

CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\CCCCCCCC.C1CC(=O)C(C(C1=O)O)SS

DOS

IR

Vibrations