Geometry & MOs

Info

ID:	276514
PubChem CID:	103824018
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	249.126598
ΔH_f, kcal/mol:	35.54
Dipole, Da:	4.22
IP(EA), eV:	-8.58(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-(quinolin-4-ylmethyl)pyridin-3-amine

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)NCC2=CN=C(S2)C(C)(C)C

DOS

IR

Vibrations