Geometry & MOs

Info

ID:	185294
PubChem CID:	77281894
Reduced:	ON6C21H22 (1)
Stoich.:	AB6C21D22 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	63.42
Dipole, Da:	7.59
IP(EA), eV:	-8.6(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-(1H-benzimidazol-2-yl)-5-(1-methylpiperidin-3-yl)oxy-3H-quinolin-2-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=CC=CC3=NC(=O)C(C(=C32)N)C4=NC5=CC=CC=C5N4

DOS

IR

Vibrations