Geometry & MOs

Info

ID:	373361
PubChem CID:	131314110
Reduced:	ClOC11H11 (1)
Stoich.:	ABC11D11 (1)
Weight, g/mol:	260.997982
ΔH_f, kcal/mol:	-45.81
Dipole, Da:	2.58
IP(EA), eV:	-9.36(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-4-(difluoromethoxy)-3-(trifluoromethyl)pyridine

Drug info:

PubChemData

Smile

CC1=C2CC(=O)CCC2=C(C=C1)Cl

DOS

IR

Vibrations