Geometry & MOs

Info

ID:	150181
PubChem CID:	53789868
Reduced:	SN4O7C25H28 (1)
Stoich.:	AB4C7D25E28 (1)
Weight, g/mol:	202.060549
ΔH_f, kcal/mol:	-272.46
Dipole, Da:	8.02
IP(EA), eV:	-8.74(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethyl-3-(1,2,2-trifluoroethenoxy)benzene

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

DOS

IR

Vibrations