Geometry & MOs

Info

ID:	161101
PubChem CID:	57390765
Reduced:	Cl2O2N8C25H34 (1)
Stoich.:	A2B2C8D25E34 (1)
Weight, g/mol:	437.075403
ΔH_f, kcal/mol:	-46.51
Dipole, Da:	3.64
IP(EA), eV:	-8.78(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-[[2-(4-methoxyphenoxy)-5-(trifluoromethyl)pyridin-4-yl]amino]benzamide

Drug info:

PubChemData

Smile

CC[C@H]1CN(CCN1C2CCN(CC2)C(=O)C3=C(N=C(C=C3)Cl)N)C4=NC=C(N=C4Cl)C(=O)NC(C)C

DOS

IR

Vibrations