Geometry & MOs

Info

ID:	427011
PubChem CID:	135155017
Reduced:	ON4C18H20 (1)
Stoich.:	AB4C18D20 (1)
Weight, g/mol:	478.200491
ΔH_f, kcal/mol:	38.17
Dipole, Da:	6.02
IP(EA), eV:	-9.06(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-amino-4-[3-(furan-2-yl)phenyl]-5-oxo-4-phenylimidazol-1-yl]methyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1N2CCC(CC2)OC3=CC=CC(=C3)C#N)C

DOS

IR

Vibrations