Geometry & MOs

Info

ID:	122266
PubChem CID:	50800531
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	364.153541
ΔH_f, kcal/mol:	-53.58
Dipole, Da:	2.13
IP(EA), eV:	-8.95(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methoxyphenyl)-2-(4-oxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1CCC2=NC3=C(C=C2C1)C(=O)N(C=N3)CCN4CCOCC4

DOS

IR

Vibrations