Geometry & MOs

Info

ID:	423293
PubChem CID:	135119242
Reduced:	SO2N3C22H23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	2.9
Dipole, Da:	6.64
IP(EA), eV:	-9.03(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-phenylpropanamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C(=O)N2CCC3(CC2)C4=C(CCO3)SC=C4)C5=CC=CC=C5

DOS

IR

Vibrations