Geometry & MOs

Info

ID:	310009
PubChem CID:	126572750
Reduced:	FON3C25H28 (1)
Stoich.:	ABC3D25E28 (1)
Weight, g/mol:	363.194677
ΔH_f, kcal/mol:	-50.86
Dipole, Da:	6.41
IP(EA), eV:	-9.5(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,8-dimethyl-N-[(6-methyl-2-oxo-4-propyl-1H-pyridin-3-yl)methyl]quinoline-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=CC(=CC(=C2)C(=O)NC(C)(C)C)C3=CN=CN=C3C(C)C)F

DOS

IR

Vibrations