Geometry & MOs

Info

ID:	283216
PubChem CID:	103964972
Reduced:	O2N3H13C14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	253.121512
ΔH_f, kcal/mol:	-23.85
Dipole, Da:	4.88
IP(EA), eV:	-8.61(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[2,5-dihydro-1H-[1,4]diazepino[2,3-c]quinoline-3,1'-cyclobutane]-4-one

Drug info:

PubChemData

Smile

C1C2C(CO1)NC3=C(C=NC4=CC=CC=C43)NC2=O

DOS

IR

Vibrations