Geometry & MOs

Info

ID:	408185
PubChem CID:	135080945
Reduced:	FNO2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	240.01498
ΔH_f, kcal/mol:	-80.77
Dipole, Da:	6.23
IP(EA), eV:	-8.98(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-1-bromobut-1-enoxy]-3-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(=C(C=O)F)N2CCCC2

DOS

IR

Vibrations