Geometry & MOs

Info

ID:	372612
PubChem CID:	131300780
Reduced:	ON4C8H12 (1)
Stoich.:	AB4C8D12 (1)
Weight, g/mol:	277.9918
ΔH_f, kcal/mol:	-9.65
Dipole, Da:	5.64
IP(EA), eV:	-8.11(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(bromomethyl)-3-[1-(trifluoromethyl)cyclopropyl]benzene

Drug info:

PubChemData

Smile

CC1C(=O)NC2=C(NC=C2N1C)N

DOS

IR

Vibrations