Geometry & MOs

Info

ID:	423214
PubChem CID:	135119127
Reduced:	O4N5C18H23 (1)
Stoich.:	A4B5C18D23 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	-76.72
Dipole, Da:	5.04
IP(EA), eV:	-9.26(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)-2-(3-methylpyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)C(=O)C3=CN=C(N=C3)N4CCOCC4

DOS

IR

Vibrations