Geometry & MOs

Info

ID:	149506
PubChem CID:	53789179
Reduced:	NO7C21H23 (1)
Stoich.:	AB7C21D23 (1)
Weight, g/mol:	631.637964
ΔH_f, kcal/mol:	-233.41
Dipole, Da:	5.84
IP(EA), eV:	-9.06(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4,5-dihydro-1H-imidazol-2-yl)icosyl]octadecanamide

Drug info:

PubChemData

Smile

CC1(C2=CC(=O)C=CC2=NC3=C1C=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C

DOS

IR

Vibrations