Geometry & MOs

Info

ID:	420285
PubChem CID:	135112251
Reduced:	NO2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	329.185175
ΔH_f, kcal/mol:	-144.99
Dipole, Da:	6.3
IP(EA), eV:	-8.82(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamidophenyl)-2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]acetamide

Drug info:

PubChemData

Smile

CCOCC1=C(C=CC(=C1)CN2C[C@@H]3COC[C@H](C2)NC3=O)OC

DOS

IR

Vibrations