Geometry & MOs

Info

ID:	398571
PubChem CID:	135033953
Reduced:	N2F5O7H11C21 (1)
Stoich.:	A2B5C7D11E21 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-427.38
Dipole, Da:	5.84
IP(EA), eV:	-10.27(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4S)-15-methyl-6-azapentacyclo[8.6.0.01,6.02,13.04,10]hexadecane-8,11-diol

Drug info:

PubChemData

Smile

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCC(=O)OC4=C(C(=C(C(=C4F)F)F)F)F

DOS

IR

Vibrations