Geometry & MOs

Info

ID:	416685
PubChem CID:	135090055
Reduced:	SN2O4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	-155.58
Dipole, Da:	3.92
IP(EA), eV:	-9.04(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)-4-(4-propan-2-ylphenyl)butanamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)C)CO

DOS

IR

Vibrations