Geometry & MOs

Info

ID:	232785
PubChem CID:	87576995
Reduced:	NO2C11H11 (2)
Stoich.:	AB2C11D11 (2)
Weight, g/mol:	188.079572
ΔH_f, kcal/mol:	-126.9
Dipole, Da:	7.76
IP(EA), eV:	-8.79(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-4-methoxy-3-methyl-5-(trideuteriomethyl)pyridine

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=C(NC2=C1C(=O)CCC2)/C=C/3\C4=CC=CC=C4NC3=O

DOS

IR

Vibrations