Geometry & MOs

Info

ID:	247504
PubChem CID:	103071960
Reduced:	N2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	261.111341
ΔH_f, kcal/mol:	-100.24
Dipole, Da:	3.5
IP(EA), eV:	-8.82(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)prop-2-enyl]-6-nitro-3,4-dihydroquinolin-2-one

Drug info:

PubChemData

Smile

CC(C)NCC(=C)CN1C(=O)CCCCC1=O

DOS

IR

Vibrations