Geometry & MOs

Info

ID:	285529
PubChem CID:	104110099
Reduced:	BrON3C11H18 (1)
Stoich.:	ABC3D11E18 (1)
Weight, g/mol:	293.05276
ΔH_f, kcal/mol:	-37.93
Dipole, Da:	2.73
IP(EA), eV:	-9.14(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromopentan-2-yl)phthalazin-1-amine

Drug info:

PubChemData

Smile

CCOC1=NC(=NC=C1)NC(C)CC(C)Br

DOS

IR

Vibrations