Geometry & MOs

Info

ID:	315353
PubChem CID:	126625684
Reduced:	OF3N5C22H28 (1)
Stoich.:	AB3C5D22E28 (1)
Weight, g/mol:	364.05354
ΔH_f, kcal/mol:	-134.19
Dipole, Da:	6.3
IP(EA), eV:	-9.35(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-ethoxyethoxy)-4-(3-iodopropoxymethyl)benzene

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(CC(N)NC(=NCC(C)C)NC(=O)C2=CC(=C(C=C2)F)F)N)F

DOS

IR

Vibrations