Geometry & MOs

Info

ID:

436582

PubChem CID:

135205627

Reduced:

FSO2N7H24C28 (1)

Stoich.:

ABC2D7E24F28 (1)

Weight, g/mol:

614.165615

ΔHf, kcal/mol:

33.05

Dipole, Da:

4.47

IP(EA), eV:

 -8.73(-1.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[4-[5-chloro-2-[4-(trifluoromethyl)imidazol-1-yl]phenyl]-5-methoxy-2-oxopyridin-1-yl]-4-methoxy-N-(2-methylindazol-5-yl)butanamide

Drug info:

PubChemData

Smile

C=CC(=O)N1CCC(C1)NC2=NNC3=NC=CC(=C32)C4=CC(=C(C=C4)CNC(=O)C5=CC6=C(C=C5)SC=N6)F

DOS

IR

Vibrations