Geometry & MOs

Info

ID:	175935
PubChem CID:	75969705
Reduced:	BFSN6O10C39H46 (1)
Stoich.:	ABCD6E10F39G46 (1)
Weight, g/mol:	1622.673647
ΔH_f, kcal/mol:	-440.09
Dipole, Da:	11.08
IP(EA), eV:	-9.78(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

B1(C2=C(CO1)C=CC(=C2)CNC(=O)NC3CCCCCC=CC4CC4(NC(=O)C5CC(CN5C3=O)OC(=O)N6CC7=C(C6)C(=CC=C7)F)C(=O)NS(=O)(=O)C8CC8)O

DOS

IR

Vibrations