Geometry & MOs

Info

ID:	70177
PubChem CID:	47208526
Reduced:	O3N4C11H14 (1)
Stoich.:	A3B4C11D14 (1)
Weight, g/mol:	302.058196
ΔH_f, kcal/mol:	-118.1
Dipole, Da:	6.99
IP(EA), eV:	-8.95(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(2-chloro-4-fluorobenzoyl)hydrazinyl]-1-oxopropan-2-yl]urea

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N)NC(=O)CNC(=O)N

DOS

IR

Vibrations