Geometry & MOs

Info

ID:	229657
PubChem CID:	87568337
Reduced:	BrClN2O3H18C19 (1)
Stoich.:	ABC2D3E18F19 (1)
Weight, g/mol:	310.08112
ΔH_f, kcal/mol:	-14.78
Dipole, Da:	6.09
IP(EA), eV:	-8.65(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CNC(=O)/C(=N/OC)/C1=CC=CC=C1COC2=CC=C(C=C2)/C=C(\Cl)/Br

DOS

IR

Vibrations