Geometry & MOs

Info

ID:	147623
PubChem CID:	53787279
Reduced:	O2N4F6C23H24 (1)
Stoich.:	A2B4C6D23E24 (1)
Weight, g/mol:	529.315186
ΔH_f, kcal/mol:	-325.93
Dipole, Da:	5.32
IP(EA), eV:	-9.3(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 7-[3-[(2-acetyloxy-2-cyclohexylethyl)amino]-1-benzyl-5-hydroxy-2-oxoimidazol-4-yl]heptanoate

Drug info:

PubChemData

Smile

C1CC(C(N(C1)CN(C=O)C(=N)N)C2=CC=CC=C2)OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations