Geometry & MOs

Info

ID:	387611
PubChem CID:	134986155
Reduced:	NPO3C6H8 (1)
Stoich.:	ABC3D6E8 (1)
Weight, g/mol:	303.92853
ΔH_f, kcal/mol:	-162.43
Dipole, Da:	5.23
IP(EA), eV:	-10.22(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-1,2-dibromopent-1-enyl]benzene

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)P(=O)(O)O

DOS

IR

Vibrations