Geometry & MOs

Info

ID:	285934
PubChem CID:	104138701
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-38.78
Dipole, Da:	3.99
IP(EA), eV:	-8.87(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyloxolan-2-yl)methylamino]-6-propylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)NC2=CC(=CC(=N2)C(C)C)C(=O)O

DOS

IR

Vibrations