Geometry & MOs

Info

ID:	227696
PubChem CID:	87562250
Reduced:	O8C59H116 (1)
Stoich.:	A8B59C116 (1)
Weight, g/mol:	258.07712
ΔH_f, kcal/mol:	-617.4
Dipole, Da:	6.62
IP(EA), eV:	-10.46(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-tert-butyl-6-chloro-2-(hydroxymethyl)pyridin-3-yl] carbamate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O

DOS

IR

Vibrations