Geometry & MOs

Info

ID:	191304
PubChem CID:	78127770
Reduced:	F2O2N4H20C21 (1)
Stoich.:	A2B2C4D20E21 (1)
Weight, g/mol:	662.377846
ΔH_f, kcal/mol:	-79.98
Dipole, Da:	6.42
IP(EA), eV:	-8.51(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1,2-bis(1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl)ethylideneamino] N,N-dimethylcarbamate

Drug info:

PubChemData

Smile

C1CC(N(C1)C2=CC3=C(C=NN3C=C2)C(=O)N4CC(C4)O)C5=C(C=CC(=C5)F)F

DOS

IR

Vibrations