Geometry & MOs

Info

ID:	295582
PubChem CID:	117535295
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	7.51
Dipole, Da:	5.13
IP(EA), eV:	-8.48(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[3-methyl-5-(4-propan-2-ylphenyl)imidazol-4-yl]ethanamine

Drug info:

PubChemData

Smile

CNCCC1=C(N=CN1C)C2=CC(=CC=C2)OC

DOS

IR

Vibrations