Geometry & MOs

Info

ID:	20954
PubChem CID:	586348
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-61.74
Dipole, Da:	3.55
IP(EA), eV:	-9.43(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(6-methylpyridin-3-yl)butane-2,3-diol

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)C(C)(C(C)(C2=CN=C(C=C2)C)O)O

DOS

IR

Vibrations