Geometry & MOs

Info

ID:	313060
PubChem CID:	126611520
Reduced:	NO2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	234.013285
ΔH_f, kcal/mol:	-118.81
Dipole, Da:	5.05
IP(EA), eV:	-9.48(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-nitro-1,2-dihydropyridin-2-yl)disulfanyl]ethanol

Drug info:

PubChemData

Smile

CC(C)(CCOC(C)(C)CCC=O)N

DOS

IR

Vibrations