Geometry & MOs

Info

ID:	232611
PubChem CID:	87576516
Reduced:	BrNO2C8H8 (1)
Stoich.:	ABC2D8E8 (1)
Weight, g/mol:	336.12058
ΔH_f, kcal/mol:	-58.24
Dipole, Da:	2.58
IP(EA), eV:	-9.17(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1COC2=C1N=C(C(=C2)CO)Br

DOS

IR

Vibrations