Geometry & MOs

Info

ID:	416545
PubChem CID:	135089619
Reduced:	NCl2O4H13C14 (1)
Stoich.:	AB2C4D13E14 (1)
Weight, g/mol:	293.210327
ΔH_f, kcal/mol:	-134.57
Dipole, Da:	6.26
IP(EA), eV:	-9.72(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]propanamide

Drug info:

PubChemData

Smile

C1[C@]2([C@@]1(CN(C2)CC3=CC(=C(C=C3)Cl)Cl)C(=O)O)C(=O)O

DOS

IR

Vibrations