Geometry & MOs

Info

ID:	43585
PubChem CID:	10321500
Reduced:	ClOF4N5H12C20 (1)
Stoich.:	ABC4D5E12F20 (1)
Weight, g/mol:	449.059005
ΔH_f, kcal/mol:	-125.64
Dipole, Da:	2.42
IP(EA), eV:	-9.7(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-chloro-4,5-difluorobenzoyl)carbamoylamino]-4-methoxyphenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=C(C=C3)C#N)Cl)F

DOS

IR

Vibrations