Geometry & MOs

Info

ID:	414731
PubChem CID:	135087692
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	353.153955
ΔH_f, kcal/mol:	5.12
Dipole, Da:	3.96
IP(EA), eV:	-9.02(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-fluorophenyl)-N-(2-hydroxyethyl)-N-[(3-methylimidazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](CO1)NC(=O)C2=CC(=NN2)N)CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations