Geometry & MOs

Info

ID:	216684
PubChem CID:	85086606
Reduced:	ON2H6C8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	292.1075
ΔH_f, kcal/mol:	75.85
Dipole, Da:	5.85
IP(EA), eV:	-9.04(-2.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-3-phenylcyclopropyl)-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2C=CC=C3C2=NN=C4C3=NNC4=O

DOS

IR

Vibrations