Geometry & MOs

Info

ID:	414808
PubChem CID:	135087771
Reduced:	NO4C21H31 (1)
Stoich.:	AB4C21D31 (1)
Weight, g/mol:	351.134969
ΔH_f, kcal/mol:	-175.3
Dipole, Da:	4.74
IP(EA), eV:	-8.25(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenoxy)-N-(2-hydroxyethyl)-N-[(5-methyl-1H-imidazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)C(=O)C3=CC(=C(C=C3)OCC)OCC)O

DOS

IR

Vibrations