Geometry & MOs

Info

ID:	422893
PubChem CID:	135118576
Reduced:	ON4C21H24 (1)
Stoich.:	AB4C21D24 (1)
Weight, g/mol:	291.231063
ΔH_f, kcal/mol:	32.63
Dipole, Da:	0.48
IP(EA), eV:	-8.81(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1H-imidazol-2-ylmethyl-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]amino]ethanol

Drug info:

PubChemData

Smile

CCCC1=CN=C(N=C1)N[C@H]2COC[C@H]2CC3=CC=NC4=CC=CC=C34

DOS

IR

Vibrations