Geometry & MOs

Info

ID:	63569
PubChem CID:	26758651
Reduced:	ClFNO4H19C20 (1)
Stoich.:	ABCD4E19F20 (1)
Weight, g/mol:	438.142485
ΔH_f, kcal/mol:	-193.87
Dipole, Da:	5.18
IP(EA), eV:	-9.05(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[4-(difluoromethoxy)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)[C@H](C)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations