Geometry & MOs

Info

ID:	442353
PubChem CID:	135251553
Reduced:	N2O4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	216.112585
ΔH_f, kcal/mol:	-151.71
Dipole, Da:	4.78
IP(EA), eV:	-9.11(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-2,3,5-trifluoro-4,6-dimethylbenzene

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C(=O)NC1=C(C=C(C=C1OC)C)OC

DOS

IR

Vibrations