Geometry & MOs

Info

ID:	187931
PubChem CID:	77644977
Reduced:	O3C19H24 (1)
Stoich.:	A3B19C24 (1)
Weight, g/mol:	424.38175
ΔH_f, kcal/mol:	-119.54
Dipole, Da:	5.16
IP(EA), eV:	-9.54(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-icosan-2-ylphenyl)imidazole

Drug info:

PubChemData

Smile

CC12CCCCC1CCC3C2C(=O)CC4(C3=CC(=O)C4=O)C

DOS

IR

Vibrations