Geometry & MOs

Info

ID:	379005
PubChem CID:	134228853
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	246.01679
ΔH_f, kcal/mol:	-34.43
Dipole, Da:	5.54
IP(EA), eV:	-10.11(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-fluoro-1-N-propan-2-ylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1)C=N/C(=C/C(=O)O)/C

DOS

IR

Vibrations