Geometry & MOs

Info

ID:	142724
PubChem CID:	53082171
Reduced:	O2N3F4H13C24 (1)
Stoich.:	A2B3C4D13E24 (1)
Weight, g/mol:	464.13184
ΔH_f, kcal/mol:	-131.48
Dipole, Da:	3.33
IP(EA), eV:	-9.24(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-4-[2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylimidazol-1-yl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)F)C4=NC(=NO4)C5=CC(=CC=C5)C(F)(F)F

DOS

IR

Vibrations