Geometry & MOs

Info

ID:	417591
PubChem CID:	135102172
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	338.191818
ΔH_f, kcal/mol:	-63.78
Dipole, Da:	4.83
IP(EA), eV:	-8.94(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(2,6-difluoro-4-methoxyphenyl)methyl]-N,N-dimethyl-N'-[(5-methyl-1H-imidazol-4-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2CCN(CC2)C(=O)COC3=CN=CC=C3

DOS

IR

Vibrations