Geometry & MOs

Info

ID:	286572
PubChem CID:	104177780
Reduced:	O2N3C15H19 (1)
Stoich.:	A2B3C15D19 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	4.29
Dipole, Da:	8.13
IP(EA), eV:	-8.88(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-N-(2-methyl-6-nitroquinolin-4-yl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C2C=C(C=CC2=N1)[N+](=O)[O-])NCC(C)(C)C

DOS

IR

Vibrations