Geometry & MOs

Info

ID:	120659
PubChem CID:	50739319
Reduced:	FO5N6C30H39 (1)
Stoich.:	AB5C6D30E39 (1)
Weight, g/mol:	356.163711
ΔH_f, kcal/mol:	-237.62
Dipole, Da:	3.76
IP(EA), eV:	-8.87(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-7-[[(5-methylpyridin-2-yl)amino]-pyridin-4-ylmethyl]quinolin-8-ol

Drug info:

PubChemData

Smile

CC(C)C(=O)NC1=C(C=CC(=C1)NC(=O)CCNC(=O)C2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)N(C)C)F

DOS

IR

Vibrations