Geometry & MOs

Info

ID:	125825
PubChem CID:	50940831
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	262.192105
ΔH_f, kcal/mol:	-34.86
Dipole, Da:	3.29
IP(EA), eV:	-8.72(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-3-((214C)4,5-dihydro-1H-imidazol-2-ylmethyl)-2,4-dimethylphenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C[14C]#N)C)O)C(C)(C)C

DOS

IR

Vibrations