Geometry & MOs

Info

ID:	422481
PubChem CID:	135117909
Reduced:	F2O2N4C17H22 (1)
Stoich.:	A2B2C4D17E22 (1)
Weight, g/mol:	294.115047
ΔH_f, kcal/mol:	-142.49
Dipole, Da:	6.01
IP(EA), eV:	-8.72(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(3-methylimidazol-4-yl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)C(=O)C2=CC(=CC=C2)OC(F)F

DOS

IR

Vibrations