Geometry & MOs

Info

ID:	218997
PubChem CID:	85090321
Reduced:	O2N3C23H23 (1)
Stoich.:	A2B3C23D23 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-27.55
Dipole, Da:	7.92
IP(EA), eV:	-8.9(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-3-(4-methoxyphenyl)-10-methylpyrimido[4,5-b]quinoline-4,5-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4N3C)CC(C)C

DOS

IR

Vibrations