Geometry & MOs

Info

ID:	375584
PubChem CID:	134214029
Reduced:	ClOF3N4H18C20 (1)
Stoich.:	ABC3D4E18F20 (1)
Weight, g/mol:	475.067731
ΔH_f, kcal/mol:	-127.38
Dipole, Da:	8.5
IP(EA), eV:	-9.28(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-chloro-5-(2-hydroxyethyl)pyridin-2-yl]-N-[3-chloro-4-(trifluoromethoxy)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC=C1C2=C(C=C(C=N2)CC=N)Cl)C(=O)NC3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations