Geometry & MOs

Info

ID:	369966
PubChem CID:	127336957
Reduced:	N3O4C17H21 (1)
Stoich.:	A3B4C17D21 (1)
Weight, g/mol:	362.184172
ΔH_f, kcal/mol:	-153.02
Dipole, Da:	5.57
IP(EA), eV:	-9.48(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-hydroxy-2-(oxan-4-yl)ethyl]-7,7-dimethyl-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2)C(=O)NCC(C3CCOCC3)O

DOS

IR

Vibrations