Geometry & MOs

Info

ID:	228118
PubChem CID:	87563484
Reduced:	N2O3C25H31 (1)
Stoich.:	A2B3C25D31 (1)
Weight, g/mol:	370.131742
ΔH_f, kcal/mol:	-75.94
Dipole, Da:	3.23
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.768688
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-methyl-4-pyridin-2-yloxyphenoxy)quinolin-6-yl]acetaldehyde

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C(=O)[C@H](CC1=CC=CC=C1)[N+]2(CCCC2=O)CC3=CC=CC=C3

DOS

IR

Vibrations