Geometry & MOs

Info

ID:	440169
PubChem CID:	135230078
Reduced:	OSC15H26 (1)
Stoich.:	ABC15D26 (1)
Weight, g/mol:	426.20723
ΔH_f, kcal/mol:	-78.1
Dipole, Da:	3.7
IP(EA), eV:	-8.71(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-6-[[methoxy-[(4-methylphenyl)methyl]phosphoryl]amino]-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

CCCCSC(C)(C)C1CC(=O)C(C1=C)CC

DOS

IR

Vibrations