Geometry & MOs

Info

ID:	211747
PubChem CID:	81053132
Reduced:	SN2O3C14H24 (1)
Stoich.:	AB2C3D14E24 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-139.56
Dipole, Da:	5.26
IP(EA), eV:	-8.7(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-ethylpentan-2-ylamino)-2,6-dimethylpyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)S(=O)(=O)N(C)CCOC(C)C)N

DOS

IR

Vibrations