Geometry & MOs

Info

ID:	418958
PubChem CID:	135107221
Reduced:	NO3C23H35 (1)
Stoich.:	AB3C23D35 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-151.93
Dipole, Da:	5.37
IP(EA), eV:	-8.3(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)-2,2-dimethylbutanamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)CCCC(=O)N2CCC[C@@]3(C2)CCC[C@H]3OC)C

DOS

IR

Vibrations