Geometry & MOs

Info

ID:	148412
PubChem CID:	53788074
Reduced:	SN2F3O3C14H15 (1)
Stoich.:	AB2C3D3E14F15 (1)
Weight, g/mol:	211.98368
ΔH_f, kcal/mol:	-279.89
Dipole, Da:	3.5
IP(EA), eV:	-9.43(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-4-ethenyl-6-methylphenol

Drug info:

PubChemData

Smile

CC(C)NC(=O)OC1CN(C(=O)S1)C2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations