Geometry & MOs

Info

ID:	55115
PubChem CID:	17389782
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	370.168128
ΔH_f, kcal/mol:	-33.42
Dipole, Da:	3.52
IP(EA), eV:	-9.33(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethenyl-3-(2-phenylquinoline-4-carbonyl)azepan-2-one

Drug info:

PubChemData

Smile

C=CN1CCCCC(C1=O)C(=O)C2=CC=NC=C2

DOS

IR

Vibrations