Geometry & MOs

Info

ID:	243928
PubChem CID:	99302854
Reduced:	ClFON4C21H22 (1)
Stoich.:	ABCD4E21F22 (1)
Weight, g/mol:	479.11682
ΔH_f, kcal/mol:	3.28
Dipole, Da:	5.96
IP(EA), eV:	-8.53(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-3-[3-[2-[5-(diethylaminomethyl)furan-2-carbonyl]hydrazinyl]-3-oxopropyl]urea

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CC=CC=C1F)C(=O)C2=NN(C=C2)C3=CC=CC=C3Cl

DOS

IR

Vibrations