Geometry & MOs

Info

ID:	326874
PubChem CID:	126688468
Reduced:	N4O6H22C23 (1)
Stoich.:	A4B6C22D23 (1)
Weight, g/mol:	405.143704
ΔH_f, kcal/mol:	-159.36
Dipole, Da:	6.65
IP(EA), eV:	-8.84(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-[1-(3-hydroxypropyl)-5-(2-oxo-1,3-oxazolidin-3-yl)benzimidazol-2-yl]benzamide

Drug info:

PubChemData

Smile

C1COCC(=O)N1C2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC5=C(C=C4)C(=O)OC5)CCCO

DOS

IR

Vibrations