Geometry & MOs

Info

ID:	282381
PubChem CID:	103924336
Reduced:	BrFNOC11H15 (1)
Stoich.:	ABCDE11F15 (1)
Weight, g/mol:	213.071368
ΔH_f, kcal/mol:	-79.04
Dipole, Da:	1.13
IP(EA), eV:	-9.33(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-1-(2,3-difluorophenyl)ethylideneamino]urea

Drug info:

PubChemData

Smile

CC[C@H](CO)NCC1=C(C=C(C=C1)F)Br

DOS

IR

Vibrations