Geometry & MOs

Info

ID:	131255
PubChem CID:	51182228
Reduced:	ClSN3O3C18H18 (1)
Stoich.:	ABC3D3E18F18 (1)
Weight, g/mol:	364.05569
ΔH_f, kcal/mol:	-42.4
Dipole, Da:	3.48
IP(EA), eV:	-8.96(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dichloro-N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-1-methylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(CCC1=CC=CO1)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations