Geometry & MOs

Info

ID:	422712
PubChem CID:	135118289
Reduced:	ON6C16H18 (1)
Stoich.:	AB6C16D18 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	46.85
Dipole, Da:	2.7
IP(EA), eV:	-8.53(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylphenyl)-N-(2-hydroxyethyl)-N-[(3-methylimidazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

C1CN(C(C2=C1NC=N2)C3=CC=CC=N3)CCN4C=CNC4=O

DOS

IR

Vibrations