Geometry & MOs

Info

ID:	44078
PubChem CID:	10500661
Reduced:	NO4C24H25 (1)
Stoich.:	AB4C24D25 (1)
Weight, g/mol:	391.210721
ΔH_f, kcal/mol:	-79.6
Dipole, Da:	5.79
IP(EA), eV:	-8.31(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[2-hydroxy-2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethyl]amino]-2-methylpropyl]carbamate

Drug info:

PubChemData

Smile

C/C=C/1\C2C3=CC(=C(C=C3CCN2C(=CC1=O)C4=CC=C(C=C4)OC)OC)OC

DOS

IR

Vibrations