Geometry & MOs

Info

ID:	227313
PubChem CID:	87561210
Reduced:	ClOF2N4C15H19 (1)
Stoich.:	ABC2D4E15F19 (1)
Weight, g/mol:	535.181612
ΔH_f, kcal/mol:	-93.69
Dipole, Da:	5.58
IP(EA), eV:	-9.09(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C2=NC(=NC3=C2OC=C3)Cl)CNCC(F)F

DOS

IR

Vibrations