Geometry & MOs

Info

ID:	445688
PubChem CID:	135268930
Reduced:	ClIN4O4C22H26 (1)
Stoich.:	ABC4D4E22F26 (1)
Weight, g/mol:	359.248524
ΔH_f, kcal/mol:	-64.79
Dipole, Da:	6.79
IP(EA), eV:	-9.2(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[amino(methyl)amino]ethenyl]-N-ethenyl-2-[(3-fluorophenyl)methyl]-3-(3-methylbutyl)-1,2-dihydroimidazol-5-amine

Drug info:

PubChemData

Smile

CCCCCOC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)N(C(=O)C(C2)I)CCCN=O

DOS

IR

Vibrations