Geometry & MOs

Info

ID:	43973
PubChem CID:	10322570
Reduced:	N4O7C23H28 (1)
Stoich.:	A4B7C23D28 (1)
Weight, g/mol:	473.17329
ΔH_f, kcal/mol:	-247.08
Dipole, Da:	8.08
IP(EA), eV:	-8.56(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-N-[1-(1H-imidazol-5-yl)-2-[4-[(2-methylquinolin-4-yl)methoxy]piperidin-1-yl]sulfonylethyl]formamide

Drug info:

PubChemData

Smile

CN(C)[C@H]1C2CC3CC4=C(C=C(C(=C4C(=C3C(=O)[C@@]2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)N)N(C)C

DOS

IR

Vibrations