Geometry & MOs

Info

ID:	19399
PubChem CID:	563040
Reduced:	N4O4H18C21 (1)
Stoich.:	A4B4C18D21 (1)
Weight, g/mol:	390.132805
ΔH_f, kcal/mol:	28.57
Dipole, Da:	8.35
IP(EA), eV:	-9.13(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-benzylimidazol-2-yl)methoxy]-6-methoxy-8-nitroquinoline

Drug info:

PubChemData

Smile

COC1=CC(=C2C(=C1)C=CC(=N2)OCC3=NC=CN3CC4=CC=CC=C4)[N+](=O)[O-]

DOS

IR

Vibrations