Geometry & MOs

Info

ID:	162430
PubChem CID:	57394642
Reduced:	SN2O3H18C22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	199.95853
ΔH_f, kcal/mol:	-26.48
Dipole, Da:	5.15
IP(EA), eV:	-8.45(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-methyl-6-nitrosopyridine

Drug info:

PubChemData

Smile

CC1=CC=CC2N1C([C@@H]3[C@H]2C(=O)N(C3=O)C4=CC=CC=C4)C(=O)C5=CC=CS5

DOS

IR

Vibrations