Geometry & MOs

Info

ID:	283203
PubChem CID:	103964037
Reduced:	O3N4H12C14 (1)
Stoich.:	A3B4C12D14 (1)
Weight, g/mol:	257.116427
ΔH_f, kcal/mol:	57.12
Dipole, Da:	5.27
IP(EA), eV:	-9.43(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylcyclopropyl)-3-nitroquinolin-4-amine

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CNC2=C(C=NC3=CC=CC=C32)[N+](=O)[O-]

DOS

IR

Vibrations