Geometry & MOs

Info

ID:	447489
PubChem CID:	135283307
Reduced:	ClOF2N2H5C10 (1)
Stoich.:	ABC2D2E5F10 (1)
Weight, g/mol:	304.121178
ΔH_f, kcal/mol:	-51.11
Dipole, Da:	6.16
IP(EA), eV:	-8.91(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10Z,13Z,15Z)-8,12-dioxa-18,20-diazatricyclo[17.3.1.02,7]tricosa-1(23),2,4,6,10,13,15,17,19,21-decaene

Drug info:

PubChemData

Smile

C1=C/C(=C\2/C(=CN=C(N2)Cl)F)/C(=O)C(=C1)F

DOS

IR

Vibrations