Geometry & MOs

Info

ID:	285914
PubChem CID:	104137094
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	237.111341
ΔH_f, kcal/mol:	-100.86
Dipole, Da:	5.53
IP(EA), eV:	-8.91(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-amino-2-oxoethyl)-methylamino]-6-ethylpyridine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)CC(C)NC1=CC(=CC(=N1)C(C)C)C(=O)O

DOS

IR

Vibrations